SCHEMBL7921075

SCHEMBL7921075

NC(=O)Cc1ccccc1OCc1ccc2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.53
CYSLTR1 Q9Y271 5/20 0.52
CYSLTR2 Q9NS75 3/20 0.52
ALOX5 P09917 1/20 0.50
FFAR1 O14842 1/20 0.49
AKR1B1 P15121 1/20 0.49
CYP1A2 P05177 1/20 0.49
PLA2G1B P04054 1/20 0.48

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
SCHEMBL7593150 0.89 GPBAR1 (0.56) GPBAR1CYSLTR1CYSLTR2ALOX5FFAR1
SCHEMBL9081199 0.83 CYSLTR1 (0.61) GPBAR1CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL9847314 0.83 CYSLTR1 (0.58) GPBAR1CYSLTR1CYSLTR2PLA2G1B
SCHEMBL28030524 0.82 NPC1 (0.57) GPBAR1CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL9018928 0.81 GPBAR1 (0.46) GPBAR1CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL7504604 0.80 CYSLTR1 (0.58) GPBAR1CYSLTR1CYSLTR2
SCHEMBL8902567 0.80 ALOX5 (0.72) GPBAR1CYSLTR1CYSLTR2ALOX5FFAR1
SCHEMBL29877127 0.79 CYP1A2 (0.63) GPBAR1CYSLTR1CYSLTR2ALOX5AKR1B1
SCHEMBL5503169 0.79 CYP1A2 (0.63) GPBAR1CYSLTR1CYSLTR2ALOX5AKR1B1
SCHEMBL8834234 0.79 GPBAR1 (0.57) GPBAR1CYSLTR1CYSLTR2ALOX5FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530639-B1 Quinolylmethoxy-phenylacetamides substituted by a heterocycle as lipoxygenase inhibitors BAYER AG (DE) 1994-08-17 EP claimed
US-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US claimed
US-5266578-A Lipoxygenase inhibitors BAYER AKTIENGESELLSCHAFT (DE) 1993-11-30 US claimed
US-6277833-B1 3-HYDROXY-3-METHYL-GLUTARYL COENZYME A (HGM--COA) REDUCTASE INHIBITORS WHICH RETARD CHOLESTEROL BIOSYNTHESIS BAYER AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed
US-5861385-A Substituted triols BAYER AKTIENGESELLSCHAFT (DE) 1999-01-19 US disclosed
US-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5266578-A Lipoxygenase inhibitors BAYER AKTIENGESELLSCHAFT (DE) 1993-11-30 US disclosed
EP-0545170-A1 Quinolylmethoxyphenylacetamides BAYER AG (DE) 1993-06-09 EP disclosed
EP-0530639-A1 Quinolylmethoxy-phenylacetamides substituted by a heterocycle as lipoxygenase inhibitors BAYER AG (DE) 1993-03-10 EP disclosed