SCHEMBL4063908

SCHEMBL4063908

Cc1cccc(C)c1C(=O)Nc1ccc(Oc2cccnc2C)nc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.69
HTR2B P41595 9/20 0.55
HTR2A P28223 5/20 0.52
NPC1 O15118 1/20 0.52
MTOR P42345 1/20 0.52
RAB9A P51151 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
SCHEMBL4061768 0.88 HTR2C (0.62) HTR2CHTR2BHTR2ANPC1MTOR
SCHEMBL4061677 0.88 HTR2C (0.53) HTR2CNPC1MTORRAB9A
SCHEMBL4073222 0.87 HTR2C (0.71) HTR2CHTR2BHTR2ANPC1MTOR
SCHEMBL4060843 0.82 HTR2C (0.50) HTR2CMTORRAB9A
SCHEMBL4062759 0.82 HTR2C (0.54) HTR2CNPC1MTORRAB9A
SCHEMBL4236768 0.82 HTR2C (1.00) HTR2CHTR2B
SCHEMBL4058761 0.81 HTR2C (0.48) HTR2CMTORRAB9A
SCHEMBL4065333 0.81 HTR2C (0.48) HTR2CHTR2BNPC1MTORRAB9A
SCHEMBL4058614 0.81 GRM8 (0.53) HTR2CHTR2BHTR2A
SCHEMBL4229637 0.79 HTR2C (0.67) HTR2CHTR2BHTR2A

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-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed