SCHEMBL8538103

SCHEMBL8538103

COc1ccc2ncccc2c1NC(=O)Nc1c(-c2ccccc2Cl)c2cc(C(C)C)ccc2n(C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
MAPT P10636 4/20 0.37
RXFP1 Q9HBX9 1/20 0.37
FGFR1 P11362 1/20 0.37
FGFR4 P22455 1/20 0.37
KDM4E B2RXH2 3/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
BRD4 O60885 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL8545213 0.91 CYP1A2 (0.42) HTR2CHTR2BMAPTFGFR1FGFR4
SCHEMBL8540727 0.90 HTR2C (0.40) HTR2CHTR2BMAPTFGFR1FGFR4
SCHEMBL8539254 0.88 KDM4E (0.35) HTR2CHTR2BMAPTKDM4EBRD4
SCHEMBL8537925 0.88 MAPT (0.41) HTR2CHTR2BMAPTRXFP1FGFR1
SCHEMBL9370679 0.81 AKR1C3 (0.35) MAPTRXFP1KDM4EAKR1C3AKR1C2
SCHEMBL8540781 0.78 KDM4E (0.36) KDM4E
SCHEMBL8543771 0.78 POLB (0.36) MAPTKDM4E
SCHEMBL8544128 0.78 POLB (0.37) HTR2CHTR2BMAPT
SCHEMBL8537819 0.76 FPR2 (0.37) MAPTKDM4E
SCHEMBL8544123 0.76 MEN1 (0.37) MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623112-B1 4-Phenyl-3-(heteroarylureido)-1,2-dihydro-2-oxoquinoline derivatives as antihypercholesterolemic and antiatherosclerotic agents PFIZER (US) 1998-12-30 EP claimed
JP-2668163-B2 1997-10-27 JP claimed
US-5565472-A 4-aryl-3-(heteroarylureido)-1,2-dihydro-2-oxo-quinoline derivatives as antihypercholesterolemic and antiatherosclerotic agents PFIZER INC. (US) 1996-10-15 US claimed
WO-1993015058-A1 4-ARYL-3-(HETEROARYLUREIDO)-1,2-DIHYDRO-2-OXO-QUINOLINE DERIVATIVES AS ANTIHYPERCHOLESTEROLEMIC AND ANTIATHEROSCLEROTIC AGENTS PFIZER INC. (US) 1993-08-05 WO claimed
EP-0623112-B1 4-Phenyl-3-(heteroarylureido)-1,2-dihydro-2-oxoquinoline derivatives as antihypercholesterolemic and antiatherosclerotic agents PFIZER (US) 1998-12-30 EP disclosed
US-5565472-A 4-aryl-3-(heteroarylureido)-1,2-dihydro-2-oxo-quinoline derivatives as antihypercholesterolemic and antiatherosclerotic agents PFIZER INC. (US) 1996-10-15 US disclosed
WO-1993015058-A1 4-ARYL-3-(HETEROARYLUREIDO)-1,2-DIHYDRO-2-OXO-QUINOLINE DERIVATIVES AS ANTIHYPERCHOLESTEROLEMIC AND ANTIATHEROSCLEROTIC AGENTS PFIZER INC. (US) 1993-08-05 WO disclosed