SCHEMBL7340146

SCHEMBL7340146

CCCn1nc(C(=O)c2ccccc2)nc1Cc1ccc(-c2cnccc2C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 2/20 0.46
AGTR1 P30556 6/20 0.42
AGTR2 P50052 3/20 0.42
PPARG P37231 4/20 0.41
KDM4C Q9H3R0 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
SCHEMBL7333577 0.95 LTB4R2 (0.49) LTB4R2AGTR1AGTR2PPARG
SCHEMBL7341429 0.94 LTB4R2 (0.49) LTB4R2AGTR1AGTR2
SCHEMBL7343937 0.93 AGTR1 (0.42) LTB4R2AGTR1AGTR2PPARGKDM4C
SCHEMBL9552229 0.89 AGTR1 (0.52) AGTR1AGTR2PPARG
SCHEMBL7335143 0.89 LTB4R2 (0.46) LTB4R2AGTR1AGTR2PPARGKDM4C
SCHEMBL7337229 0.88 LTB4R2 (0.48) LTB4R2AGTR1AGTR2PPARGKDM4C
SCHEMBL7333589 0.88 LTB4R2 (0.44) LTB4R2AGTR1AGTR2PPARGKDM4C
SCHEMBL7336931 0.87 AGTR1 (0.46) LTB4R2AGTR1AGTR2PPARG
SCHEMBL7338538 0.87 LTB4R2 (0.46) LTB4R2AGTR1AGTR2PPARGKDM4C
SCHEMBL7341762 0.86 AGTR1 (0.43) LTB4R2AGTR1AGTR2PPARG

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-6090828-A ARTHERIOSCLEROSIS REITZ DAVID B (US) 2000-07-18 US disclosed
US-5451593-A Method of using 5-arylheteroarylalkyl-1,3,5-trisubstituted-1,2,4-triazole compounds for treatment of a glaucoma disorder G. D. SEARLE & CO. (US) 1995-09-19 US disclosed
US-5451591-A Method of using 5-arylheteroarylalkyl-1,3 5-trisubstituted-1,24-triazole compounds for treatment of circulatory disorders G. D. SEARLE & CO. (US) 1995-09-19 US disclosed
US-5196537-A Angiotensin/II/ antagonists; hypotensive agents G. D. SEARLE & CO. (US) 1993-03-23 US disclosed
WO-1992016523-A1 5-ARYLHETEROARYLALKYL-1,3,5-TRISUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-10-01 WO disclosed
EP-0504888-A1 5-Arylheteroarylalkyl-1,3,5-trisubstituted-1,2,4-triazole compounds for treatment of circulatory disorders G.D. Searle & Co. (US) 1992-09-23 EP disclosed