SCHEMBL6089083

SCHEMBL6089083

COC(=O)c1c(C)cccc1COc1cccc(COCc2ccc3ccccc3n2)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 11/20 0.59
GPBAR1 Q8TDU6 2/20 0.53
ALOX5 P09917 1/20 0.53
CYSLTR2 Q9NS75 7/20 0.52

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
SCHEMBL6088400 0.96 CYSLTR1 (0.62) CYSLTR1GPBAR1ALOX5CYSLTR2
SCHEMBL6089840 0.90 CYSLTR1 (0.59) CYSLTR1GPBAR1ALOX5CYSLTR2
SCHEMBL5726112 0.90 CYSLTR1 (0.69) CYSLTR1GPBAR1CYSLTR2
SCHEMBL6088989 0.87 CYSLTR1 (0.61) CYSLTR1GPBAR1ALOX5CYSLTR2
SCHEMBL6088001 0.85 CYSLTR1 (0.59) CYSLTR1GPBAR1CYSLTR2
SCHEMBL6087884 0.84 ABCB1 (0.45) CYSLTR1
SCHEMBL6090709 0.83 CYSLTR1 (0.55) CYSLTR1GPBAR1ALOX5CYSLTR2
SCHEMBL6088592 0.82 CYSLTR1 (0.48) CYSLTR1GPBAR1ALOX5CYSLTR2
SCHEMBL4848377 0.81 CYSLTR1 (0.53) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4844970 0.81 CYSLTR1 (0.50) CYSLTR1GPBAR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP claimed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO claimed
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed
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
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP 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-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO disclosed
WO-2000064876-A1 TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-11-02 WO disclosed