SCHEMBL6089190

SCHEMBL6089190

Oc1cccc(COCc2ccc3ccccc3n2)c1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.56
GPBAR1 Q8TDU6 5/20 0.56
CYSLTR2 Q9NS75 3/20 0.49
ALOX5 P09917 1/20 0.46
PDE10A Q9Y233 1/20 0.46

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
SCHEMBL10663429 0.84 CYSLTR1 (0.62) CYSLTR1GPBAR1CYSLTR2ALOX5PDE10A
SCHEMBL2353460 0.82 CYSLTR1 (0.67) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL15560182 0.82 CYSLTR1 (0.51) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL6088572 0.81 MAPT (0.44) CYSLTR1GPBAR1ALOX5PDE10A
Hydrochloric Acid SCHEMBL15549877 0.81 CYSLTR1 (0.50) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL6088643 0.78 DHODH (0.41)
SCHEMBL6089769 0.78 CYSLTR1 (0.53) CYSLTR1GPBAR1CYSLTR2
SCHEMBL6088376 0.78 CYSLTR1 (0.72) CYSLTR1GPBAR1CYSLTR2PDE10A
Hydrogen Sulfide SCHEMBL9818428 0.77 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL10635107 0.76 CYSLTR2 (0.72) CYSLTR1GPBAR1CYSLTR2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7005440-B1 Therapeutic uses of tri-aryl acid derivatives AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-02-28 US disclosed
CN-1183113-C Tri-aryl acid derivatives as PPAR receptor ligands ���ĵ�˹ҩ��¹����޹�˾ 2005-01-05 CN disclosed
CN-1356983-A Tri-aryl acid derivatives as PPAR receptor ligands AVENTIS PHARM PROD INC (DE) 2002-07-03 CN disclosed
EP-1177176-A1 TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS Aventis Pharma Deutschland GmbH (DE) 2002-02-06 EP disclosed
WO-2000064876-A1 TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-11-02 WO disclosed