SCHEMBL2809965

SCHEMBL2809965

CC(C)(C)c1ccc(-c2c(C(=O)O)n(Cc3cc(OCC4CC4)cc(C(F)(F)F)c3)c3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.49
PPARG P37231 11/20 0.46
PPARA Q07869 3/20 0.44
EDNRB P24530 3/20 0.43
EDNRA P25101 3/20 0.43
FOLH1 Q04609 1/20 0.42
MDM2 Q00987 1/20 0.39

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
SCHEMBL2807163 0.93 SERPINE1 (0.53) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2806679 0.91 SERPINE1 (0.51) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2807519 0.90 SERPINE1 (0.50) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2806740 0.89 SERPINE1 (0.49) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2811759 0.88 SERPINE1 (0.48) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2806705 0.88 SERPINE1 (0.50) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2809577 0.87 PPARG (0.51) SERPINE1PPARGPPARAEDNRBEDNRA
SCHEMBL2812769 0.87 SERPINE1 (0.47) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2814477 0.87 SERPINE1 (0.47) SERPINE1PPARGEDNRBEDNRAFOLH1
SCHEMBL2806816 0.86 SERPINE1 (0.60) SERPINE1PPARGPPARAEDNRBEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US claimed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 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-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators PPARD, PPARA, PPARG SERPINE1 4215/4885PPARG 3/4885PPARA 2/4885

“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.