SCHEMBL2009947

SCHEMBL2009947

CCCc1ccc(S(=O)(=O)Nc2c(Oc3ccc(CC(=O)O)cc3OC)ccc3[nH]c(C)cc23)c(Cl)c1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.83
PTGDR Q13258 19/20 0.78
PTGDR2 Q9Y5Y4 19/20 0.78
ABCC3 O15438 1/20 0.52
ABCC4 O15439 1/20 0.52
ABCB11 O95342 1/20 0.52
TBXA2R P21731 1/20 0.52
PTGER4 P35408 1/20 0.52
PTGER2 P43116 1/20 0.52

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
SCHEMBL2001955 0.91 CYP3A4 (1.00) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL12570808 0.89 CYP3A4 (0.81) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL12570801 0.85 CYP3A4 (0.76) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL2005257 0.84 CYP3A4 (0.87) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL12570948 0.84 CYP3A4 (0.76) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL12570965 0.84 CYP3A4 (0.87) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL12570807 0.83 CYP3A4 (0.71) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL2003621 0.82 CYP3A4 (0.82) CYP3A4PTGDRPTGDR2ABCC3ABCC4
SCHEMBL2002108 0.81 PTGDR (0.87) CYP3A4PTGDRPTGDR2
SCHEMBL1998637 0.81 PTGDR (1.00) CYP3A4PTGDRPTGDR2ABCC3ABCC4

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164828-B1 COMPOUNDS AS CRTH2 AND/OR PGD2 RECEPTORS MODULATORS AND THEIR USE FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC (US) 2013-03-27 EP disclosed
US-7960567-B2 Compounds and methods useful for treating asthma and allergic inflammation AMGEN INC. (US) 2011-06-14 US disclosed
US-7960567-B2 Compounds and methods useful for treating asthma and allergic inflammation AMGEN INC. (US) 2011-06-14 US disclosed
US-7960567-B2 Compounds and methods useful for treating asthma and allergic inflammation AMGEN INC. (US) 2011-06-14 US disclosed
EP-2164828-A2 COMPOUNDS AS CRTH2 AND/OR PGD2 RECEPTORS MODULATORS AND THEIR USE FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION Amgen Inc. (US) 2010-03-24 EP disclosed
US-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. 2008-12-18 US disclosed
US-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. 2008-12-18 US disclosed
US-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. 2008-12-18 US disclosed
WO-2008137027-A2 COMPOUNDS AS CRTH2 AND/OR PGD2 RECEPTORS MODULATORS AND THEIR USE FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION AMGEN INC. (US) 2008-11-13 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 (1 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-20080312270-A1 COMPOUNDS AND METHODS USEFUL FOR TREATING ASTHMA AND ALLERGIC INFLAMMATION CCL11, LTC4S, TSLP CYP3A4 659/4885PTGDR 296/4885PTGDR2 253/4885

“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.