SCHEMBL6140771

SCHEMBL6140771

CSc1ccc(O)c(C2=C(c3cccc(C(=O)O)c3)CCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 19/20 0.66
CYP2C9 P11712 1/20 0.45
MCL1 Q07820 1/20 0.43

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
SCHEMBL5620624 0.81 PTGER1 (0.64) PTGER1CYP2C9
SCHEMBL5619871 0.81 PTGER1 (0.62) PTGER1CYP2C9
SCHEMBL5621101 0.80 PTGER1 (0.67) PTGER1CYP2C9
SCHEMBL14499132 0.80 PTGER1 (1.00) PTGER1CYP2C9
SCHEMBL5620567 0.79 PTGER1 (0.66) PTGER1CYP2C9
SCHEMBL24732325 0.76 KMO (0.61) PTGER1CYP2C9MCL1
SCHEMBL5620526 0.72 PTGER1 (0.60) PTGER1CYP2C9
SCHEMBL6140486 0.71 PTGER1 (0.84) PTGER1CYP2C9
SCHEMBL28839717 0.70 BACE1 (0.56) MCL1
SCHEMBL659462 0.69 HSD17B10 (0.70) CYP2C9MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7232821-B2 (2-((2-alkoxy)-phenyl) -cyclopent-1enyl) aromatic carbo and heterocyclic acid and derivatives GLAXO GROUP LIMITED (GB) 2007-06-19 US disclosed
US-7232821-B2 (2-((2-alkoxy)-phenyl) -cyclopent-1enyl) aromatic carbo and heterocyclic acid and derivatives GLAXO GROUP LIMITED (GB) 2007-06-19 US disclosed
EP-1492757-A1 (2-((2-ALKOXY)-PHENYL)-CYCLOPENT-1-ENYL) AROMATIC CARBO- AND HETEROCYCLIC CARBOXYLIC ACID AND DERIVATIVES GLAXO GROUP LIMITED (GB) 2005-01-05 EP disclosed
WO-2003084917-A1 (2-((2-ALKOXY) -PHENYL) -CYCLOPENT-1-ENYL) AROMATIC CARBO AND HETEROCYCLIC ACID AND DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-10-16 WO disclosed