SCHEMBL8325939

SCHEMBL8325939

CCCCc1cn(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.57
AGTR2 P50052 5/20 0.57
LMNA P02545 1/20 0.54
PPARG P37231 1/20 0.52
CHRM1 P11229 1/20 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
SCHEMBL8327991 0.91 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL8327093 0.90 AGTR1 (0.53) AGTR1AGTR2PPARG
SCHEMBL11948564 0.90 AGTR1 (0.53) AGTR1AGTR2PPARG
SCHEMBL8411067 0.89 AGTR1 (0.54) AGTR1AGTR2CHRM1
SCHEMBL8327497 0.89 AGTR1 (0.56) AGTR1AGTR2PPARG
SCHEMBL8323093 0.89 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL8325903 0.88 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL8327533 0.88 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL8324160 0.88 AGTR1 (0.52) AGTR1AGTR2PPARG
SCHEMBL8327393 0.86 AGTR1 (0.50) AGTR1AGTR2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0498721-B1 N-substituted quinoline derivatives, process for their preparation, their use as pharmaceuticals and pharmaceutical compositions containing them HOECHST MARION ROUSSEL INC (FR) 1999-12-22 EP claimed
JP-4360872-A None JP disclosed
US-5985894-A USEFUL IN THE TREATMENT OF CARDIOVASCULAR ILLNESSES HOECHST MARION ROUSSEL (FR) 1999-11-16 US disclosed
JP-H04360872-A NEW N-SUBSTITUTED QUINOLINE DERIVATIVE, ITS PRODUCTION, NEW INTERMEDIATE OBTAINED BY THIS METHOD, ITS USE AS DRUG, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME ROUSSEL UCLAF 1992-12-14 JP disclosed