SCHEMBL2807031

SCHEMBL2807031

CC(C)(C)c1ccc(-c2c(C(=O)O)n(Cc3cc(O)cc(-c4ccc(C(=O)O)cc4)c3)c3ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 4/20 0.58
FOLH1 Q04609 4/20 0.50
EGFR P00533 2/20 0.47
EDNRB P24530 2/20 0.46
EDNRA P25101 2/20 0.46
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
PPARG P37231 3/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
NR1H4 Q96RI1 2/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL2807015 0.89 SERPINE1 (0.62) SERPINE1FOLH1EDNRBEDNRAPTGES
SCHEMBL2811879 0.88 SERPINE1 (0.55) SERPINE1FOLH1EDNRBEDNRAPPARG
SCHEMBL2811200 0.88 SERPINE1 (0.53) SERPINE1FOLH1EDNRBEDNRAPTGES
SCHEMBL2808907 0.85 SERPINE1 (0.52) SERPINE1FOLH1EGFREDNRBEDNRA
SCHEMBL2810203 0.85 SERPINE1 (0.62) SERPINE1FOLH1EDNRBEDNRAPPARG
SCHEMBL13131775 0.84 SERPINE1 (0.51) SERPINE1FOLH1EDNRBEDNRAPPARG
SCHEMBL2806746 0.83 SERPINE1 (0.46) SERPINE1EGFRPPARG
SCHEMBL2806705 0.83 SERPINE1 (0.50) SERPINE1FOLH1EDNRBEDNRAPPARG
SCHEMBL2806758 0.82 SERPINE1 (0.63) SERPINE1FOLH1EDNRBEDNRAPPARG
SCHEMBL2807174 0.82 SERPINE1 (0.61) SERPINE1FOLH1EDNRBEDNRAPPARG

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 6 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
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 4215/4885FOLH1 2056/4885EGFR 1315/4885

“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.