SCHEMBL1786702

SCHEMBL1786702

Cc1c(Cc2ccc3cc(F)ccc3n2)c2cc(F)ccc2n1CC(=O)O

nearest known ligand 0.85

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.85
PTGDR Q13258 2/20 0.85
PTGIR P43119 1/20 0.85
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2C8 P10632 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2A6 P11509 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2B6 P20813 1/20 0.60
CYP2C19 P33261 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Timapiprant SCHEMBL1782956 0.92 PTGDR2 (1.00) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
Timapiprant SCHEMBL29379400 0.92 PTGDR2 (1.00) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
Timapiprant SCHEMBL29648518 0.92 PTGDR2 (1.00) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL3992851 0.91 PTGDR2 (0.73) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL1786306 0.91 PTGDR2 (0.73) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL15016329 0.89 PTGDR2 (0.78) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL1786803 0.83 PTGDR2 (0.74) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL1782474 0.82 PTGDR2 (0.77) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL16558834 0.82 PTGDR2 (0.82) PTGDR2PTGDRPTGIRCYP1A2CYP3A4
SCHEMBL22167497 0.81 PTGDR2 (0.80) PTGDR2PTGDRPTGIRCYP1A2CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 44 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083557-B1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ATOPIX THERAPEUTICS LTD (GB) 2017-11-29 EP claimed
US-9828359-B2 Process for the preparation of 3-substituted (indol-1-yl)-acetic acid esters ATOPIX THERAPEUTICS LIMITED (GB) 2017-11-28 US claimed
US-20170305879-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ZACH SYSTEM SPA (IT) 2017-10-26 US claimed
EP-3083557-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS Atopix Therapeutics Limited (GB) 2016-10-26 EP claimed
WO-2015092372-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ATOPIX THERAPEUTICS LIMITED (GB) 2015-06-25 WO claimed
US-20140328861-A1 Combination of CRTH2 Antagonist and a Proton Pump Inhibitor for the Treatment of Eosinophilic Esophagitis ATOPIX THERAPEUTICS LTD (GB) 2014-11-06 US claimed
US-20130052190-A1 CRTH2 Antagonists for Treatment of Eosinophilic Diseases and Conditions OXAGEN LIMITED (GB) 2013-02-28 US claimed
US-8314257-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-11-20 US claimed
US-8198314-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-06-12 US claimed
US-8163936-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-04-24 US claimed
US-8163931-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-04-24 US claimed
US-20110124683-A1 Use of CRTH2 Antagonist Compounds OXAGEN LIMITED (GB) 2011-05-26 US claimed
EP-2219645-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS Oxagen Limited (GB) 2010-08-25 EP claimed
US-7582672-B2 Compounds for the treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-09-01 US claimed
WO-2009063202-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS OXAGEN LIMITED (GB) 2009-05-22 WO claimed
WO-2009063215-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS OXAGEN LIMITED (GB) 2009-05-22 WO claimed
US-20090018138-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-15 US claimed
US-20090018139-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-15 US claimed
US-20050119268-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2005-06-02 US claimed
EP-3083557-B1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ATOPIX THERAPEUTICS LTD (GB) 2017-11-29 EP disclosed
US-9828359-B2 Process for the preparation of 3-substituted (indol-1-yl)-acetic acid esters ATOPIX THERAPEUTICS LIMITED (GB) 2017-11-28 US disclosed
US-20170305879-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ZACH SYSTEM SPA (IT) 2017-10-26 US disclosed
EP-3083557-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS Atopix Therapeutics Limited (GB) 2016-10-26 EP disclosed
WO-2015092372-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS ATOPIX THERAPEUTICS LIMITED (GB) 2015-06-25 WO disclosed
US-20140328861-A1 Combination of CRTH2 Antagonist and a Proton Pump Inhibitor for the Treatment of Eosinophilic Esophagitis ATOPIX THERAPEUTICS LTD (GB) 2014-11-06 US disclosed
US-20130052190-A1 CRTH2 Antagonists for Treatment of Eosinophilic Diseases and Conditions OXAGEN LIMITED (GB) 2013-02-28 US disclosed
US-8314257-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-11-20 US disclosed
US-8198314-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-06-12 US disclosed
US-8163936-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-04-24 US disclosed
US-8163931-B2 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2012-04-24 US disclosed
US-20110124683-A1 Use of CRTH2 Antagonist Compounds OXAGEN LIMITED (GB) 2011-05-26 US disclosed
EP-2219645-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS Oxagen Limited (GB) 2010-08-25 EP disclosed
US-7582672-B2 Compounds for the treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-09-01 US disclosed
EP-1682121-B1 USE OF CRTH2 ANTAGONIST COMPOUNDS IN THERAPY OXAGEN LTD (GB) 2009-08-12 EP disclosed
WO-2009063202-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS OXAGEN LIMITED (GB) 2009-05-22 WO disclosed
WO-2009063215-A2 USE OF CRTH2 ANTAGONIST COMPOUNDS OXAGEN LIMITED (GB) 2009-05-22 WO disclosed
EP-2060258-A1 Use of CRTH2 antagonist compounds in therapy Oxagen Limited (GB) 2009-05-20 EP disclosed
US-20090023788-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-22 US disclosed
US-20090018338-A1 Treatment of CRTH2-Mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-15 US disclosed
US-20090018139-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-15 US disclosed
US-20090018138-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2009-01-15 US disclosed
EP-1682121-A1 USE OF CRTH2 ANTAGONIST COMPOUNDS IN THERAPY Oxagen Limited (GB) 2006-07-26 EP disclosed
US-20050119268-A1 Treatment of CRTH2-mediated diseases and conditions OXAGEN LIMITED (GB) 2005-06-02 US disclosed
WO-2005044260-A1 USE OF CRTH2 ANTAGONIST COMPOUNDS IN THERAPY OXAGEN LIMITED (GB) 2005-05-19 WO disclosed
WO-2005044260-A1 USE OF CRTH2 ANTAGONIST COMPOUNDS IN THERAPY OXAGEN LIMITED (GB) 2005-05-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090023788-A1 Treatment of CRTH2-mediated diseases and conditions PTGDR2, PTGER2, PTGES2 PTGDR2 1/4885PTGDR 4/4885PTGIR 18/4885
US-20090018138-A1 Treatment of CRTH2-mediated diseases and conditions PTGDR2, PTGER2, PTGES2 PTGDR2 1/4885PTGDR 4/4885PTGIR 18/4885
US-20090018338-A1 Treatment of CRTH2-Mediated diseases and conditions PTGDR2, PTGER2, PTGES2 PTGDR2 1/4885PTGDR 4/4885PTGIR 18/4885
US-20050119268-A1 Treatment of CRTH2-mediated diseases and conditions PTGDR2, PTGER2, PTGES2 PTGDR2 1/4885PTGDR 4/4885PTGIR 18/4885
US-20090018139-A1 Treatment of CRTH2-mediated diseases and conditions PTGDR2, PTGER2, PTGES2 PTGDR2 1/4885PTGDR 4/4885PTGIR 18/4885
US-20110124683-A1 Use of CRTH2 Antagonist Compounds HRH2, HRH1, HRH4 PTGDR2 25/4885PTGDR 47/4885PTGIR 45/4885
US-20130052190-A1 CRTH2 Antagonists for Treatment of Eosinophilic Diseases and Conditions HRH2, HRH1, HRH4 PTGDR2 58/4885PTGDR 119/4885PTGIR 76/4885
US-20140328861-A1 Combination of CRTH2 Antagonist and a Proton Pump Inhibitor for the Treatment of Eosinophilic Esophagitis HRH2, HRH1, HRH4 PTGDR2 59/4885PTGDR 108/4885PTGIR 156/4885
US-20170305879-A1 PROCESS FOR THE PREPARATION OF 3-SUBSTITUTED (INDOL-1-YL)-ACETIC ACID ESTERS IDO1, IDO2, SI PTGDR2 1790/4885PTGDR 1547/4885PTGIR 2286/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.