SCHEMBL7634210

SCHEMBL7634210

CCOC(=O)c1cc(=O)c2cc(F)cc(NC(=O)c3ccc4c(c3)CC(CCCc3ccccc3)O4)c2o1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 17/20 0.57
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
RAB9A P51151 1/20 0.39
GPR55 Q9Y2T6 1/20 0.37

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
SCHEMBL7627987 0.92 GPR35 (0.47) GPR35TP53THRBRAB9AGPR55
SCHEMBL7633772 0.91 GPR35 (0.55) GPR35GPR55
SCHEMBL7628831 0.85 GPR35 (0.46) GPR35TP53THRBGPR55
SCHEMBL7632378 0.82 GPR35 (0.58) GPR35GPR55
SCHEMBL7628839 0.81 GPR35 (0.47) GPR35TP53THRBRAB9AGPR55
SCHEMBL7632427 0.81 GPR35 (0.46) GPR35TP53THRBRAB9AGPR55
SCHEMBL7626486 0.81 GPR35 (0.49) GPR35GPR55
SCHEMBL7633188 0.80 GPR35 (0.44) GPR35GPR55
SCHEMBL7636724 0.80 GPR35 (0.41) GPR35GPR55
SCHEMBL7630922 0.79 GPR35 (0.49) GPR35TP53THRBRAB9AGPR55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888327-B1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2002-06-12 EP disclosed
US-5990142-A ANTIINFLAMMATORY AGENTS AND ANTIALLERGENS HAVING GOOD ORAL ADSORPTION AND BIOAVAILABILITY; CARDIOTONIC AND ANTIISCHEMIC AGENTS LABORATORIOS MENARINI S.A. (ES) 1999-11-23 US disclosed