SCHEMBL4073222

SCHEMBL4073222

Cc1ccccc1C(=O)Nc1ccc(Oc2cccnc2C)nc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 19/20 0.71
HTR2B P41595 8/20 0.57
HTR2A P28223 4/20 0.52
NPC1 O15118 1/20 0.52
MTOR P42345 1/20 0.52
RAB9A P51151 1/20 0.52
GAA P10253 1/20 0.51
HTT P42858 1/20 0.51

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
SCHEMBL4058778 0.89 GAA (0.56) HTR2CNPC1RAB9AGAAHTT
SCHEMBL4063908 0.87 HTR2C (0.69) HTR2CHTR2BHTR2ANPC1MTOR
SCHEMBL4236768 0.83 HTR2C (1.00) HTR2CHTR2B
SCHEMBL8143964 0.83 PKM (0.65) HTR2CNPC1RAB9AGAAHTT
SCHEMBL4063740 0.83 HTR2C (0.54) HTR2CNPC1RAB9AGAAHTT
SCHEMBL4069475 0.83 HTR2C (0.51) HTR2CNPC1RAB9AGAAHTT
SCHEMBL4061474 0.83 HTR2C (0.58) HTR2CNPC1RAB9AGAAHTT
SCHEMBL4230099 0.82 HTR2C (1.00) HTR2CHTR2BNPC1RAB9AHTT
SCHEMBL4243281 0.82 HTR2C (1.00) HTR2CHTR2BNPC1RAB9A
SCHEMBL4241707 0.82 HTR2C (1.00) HTR2CHTR2BNPC1

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