SCHEMBL503158

SCHEMBL503158

COc1cnc(-c2ccc(Cn3c(CC(C)(C)C(=O)O)c(SC(C)(C)C)c4cc(OCc5cnc(C)cn5)ccc43)cc2)nc1

nearest known ligand 0.87

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 20/20 0.87
CYP2C9 P11712 5/20 0.87
CYP3A4 P08684 4/20 0.87
PTGS1 P23219 3/20 0.87

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
SCHEMBL3462840 0.93 ALOX5AP (0.76) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL503310 0.93 ALOX5AP (1.00) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL5530433 0.89 ALOX5AP (1.00) ALOX5APPTGS1
SCHEMBL3462934 0.87 ALOX5AP (0.68) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL5524814 0.86 ALOX5AP (0.67) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL3478235 0.86 ALOX5AP (0.87) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL503061 0.85 ALOX5AP (0.86) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL9178392 0.85 ALOX5AP (0.81) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL3468241 0.85 ALOX5AP (0.74) ALOX5APCYP2C9CYP3A4PTGS1
SCHEMBL5530903 0.84 ALOX5AP (1.00) ALOX5APCYP2C9CYP3A4PTGS1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232031-A1 INJECTABLE FORMULATIONS FOR INTRA-ARTICULAR OR PERI-ARTICULAR ADMINISTRATION PANMIRA PHARMACEUTICALS, LLC (US) 2012-09-13 US claimed
EP-2490689-A2 INJECTABLE FORMULATIONS FOR INTRA- ARTICULAR OR PERI-ARTICULAR ADMINISTRATION Panmira Pharmaceuticals, LLC (US) 2012-08-29 EP claimed
US-20120027842-A1 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR ADMINISTRATION TO AN EYE AMIRA PHARMACEUTICALS, INC. (US) 2012-02-02 US claimed
US-20110311613-A1 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR THE TREATMENT OF DERMATOLOGICAL CONDITIONS AMIRA PHARMACEUTICAL, INC. (US) 2011-12-22 US claimed
EP-2381945-A2 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR THE TREATMENT OF DERMATOLOGICAL CONDITIONS Amira Pharmaceuticals, Inc. (US) 2011-11-02 EP claimed
EP-2379078-A2 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR ADMINISTRATION TO AN EYE Amira Pharmaceuticals, Inc. (US) 2011-10-26 EP claimed
WO-2011049979-A2 INJECTABLE FORMULATIONS FOR INTRA- ARTICULAR OR PERI-ARTICULAR ADMINISTRATION AMIRA PHARMACEUTICALS, INC. (US) 2011-04-28 WO claimed
WO-2010075315-A2 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR ADMINISTRATION TO AN EYE AMIRA PHARMACEUTICALS, INC. (US) 2010-07-01 WO claimed
WO-2010075314-A2 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR THE TREATMENT OF DERMATOLOGICAL CONDITIONS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-01 WO claimed
US-9688624-B2 DP2 antagonist and uses thereof BRICKELL BIOTECH, INC. (US) 2017-06-27 US disclosed
US-9572785-B2 DP2 antagonist and uses thereof BRICKELL BIOTECH, INC. (US) 2017-02-21 US disclosed
US-20160136119-A1 DP2 ANTAGONIST AND USES THEREOF BRICKELL BIOTECH, INC. 2016-05-19 US disclosed
US-8815917-B2 DP2 antagonist and uses thereof PANMIRA PHARMACEUTICALS, LLC (US) 2014-08-26 US disclosed
US-8785393-B2 Ophthalmic pharmaceutical compositions of DP2 receptor antagonists PANMIRA PHARMACEUTICALS, LLC (US) 2014-07-22 US disclosed
WO-2011085033-A2 DP2 ANTAGONIST AND USES THEREOF AMIRA PHARMACEUTICALS, INC. (US) 2011-07-14 WO disclosed
WO-2011049979-A2 INJECTABLE FORMULATIONS FOR INTRA- ARTICULAR OR PERI-ARTICULAR ADMINISTRATION AMIRA PHARMACEUTICALS, INC. (US) 2011-04-28 WO disclosed
US-20110034558-A1 DP2 Antagonist and Uses Thereof AMIRA PHARMACEUTICALS, INC. (US) 2011-02-10 US disclosed
WO-2011017201-A2 DP2 ANTAGONIST AND USES THEREOF AMIRA PHARMACEUTICALS, INC. (US) 2011-02-10 WO disclosed
WO-2011014587-A2 OPHTHALMIC PHARMACEUTICAL COMPOSITIONS OF DP2 RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-02-03 WO disclosed
WO-2011014588-A2 DERMAL FORMULATIONS OF DP2 RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-02-03 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 (4 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-20110034558-A1 DP2 Antagonist and Uses Thereof PTGER2, PTGES2, PTGDR2 ALOX5AP 63/4885CYP2C9 2149/4885CYP3A4 2374/4885
US-20120027842-A1 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR ADMINISTRATION TO AN EYE FEN1, SERPINB1, EYA2 ALOX5AP 100/4885CYP2C9 4727/4885CYP3A4 4571/4885
US-20110311613-A1 TOPICAL FORMULATIONS OF FLAP INHIBITORS FOR THE TREATMENT OF DERMATOLOGICAL CONDITIONS TSLP, SUCLG1, SERPINB1 ALOX5AP 96/4885CYP2C9 4681/4885CYP3A4 4448/4885
US-20160136119-A1 DP2 ANTAGONIST AND USES THEREOF PTGER2, PTGES2, PTGDR2 ALOX5AP 63/4885CYP2C9 2149/4885CYP3A4 2374/4885

“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.