SCHEMBL2811200

SCHEMBL2811200

CC(C)(C)c1ccc(-c2c(C(=O)O)n(Cc3cc(OCc4ccccc4)cc(-c4ccc(C(=O)O)cc4)c3)c3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.53
NR4A2 P43354 2/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
EDNRB P24530 5/20 0.46
EDNRA P25101 5/20 0.46
FOLH1 Q04609 1/20 0.46
NR4A1 P22736 1/20 0.44
NR4A3 Q92570 1/20 0.44
HDAC6 Q9UBN7 2/20 0.43
HDAC1 Q13547 1/20 0.43
PIN1 Q13526 1/20 0.42
PTPN1 P18031 1/20 0.41
PPARG P37231 2/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
LTC4S Q16873 1/20 0.41
BCL2 P10415 1/20 0.40

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
SCHEMBL2808907 0.91 SERPINE1 (0.52) SERPINE1EDNRBEDNRAFOLH1HDAC6
SCHEMBL2811879 0.91 SERPINE1 (0.55) SERPINE1RXRAEDNRBEDNRAFOLH1
SCHEMBL13131775 0.90 SERPINE1 (0.51) SERPINE1EDNRBEDNRAFOLH1HDAC6
SCHEMBL2806705 0.89 SERPINE1 (0.50) SERPINE1EDNRBEDNRAFOLH1PIN1
SCHEMBL2807031 0.88 SERPINE1 (0.58) SERPINE1RXRARXRBEDNRBEDNRA
SCHEMBL2808240 0.87 SERPINE1 (0.57) SERPINE1NR4A2RXRARXRBEDNRB
SCHEMBL2812683 0.86 SERPINE1 (0.51) SERPINE1NR4A2EDNRBEDNRAFOLH1
SCHEMBL2807015 0.86 SERPINE1 (0.62) SERPINE1RXRARXRBEDNRBEDNRA
SCHEMBL2806740 0.85 SERPINE1 (0.49) SERPINE1NR4A2EDNRBEDNRAFOLH1
SCHEMBL2808120 0.82 SERPINE1 (0.43) SERPINE1EDNRBEDNRAFOLH1PIN1

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 8 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
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP claimed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO 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 4215/4885NR4A2 120/4885RXRA 36/4885

“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.