SCHEMBL4320282

SCHEMBL4320282

CC(=NOC(=O)Nc1ccc(F)cc1)c1cccc(-c2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.64
ADORA3 P0DMS8 1/20 0.64
CCKAR P32238 1/20 0.64
HTR5A P47898 1/20 0.64
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
POLB P06746 1/20 0.56
MGLL Q99685 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
CYP2C9 P11712 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46

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
SCHEMBL13626235 1.00 HTR1A (0.64) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL13626294 0.91 HTR1A (0.74) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL4323726 0.91 HTR1A (0.74) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL4322420 0.87 ADORA3 (0.63) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL13626249 0.87 ADORA3 (0.63) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL4314640 0.85 HTR1A (0.70) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL13626255 0.85 HTR1A (0.70) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL4325642 0.81 HTR1A (0.65) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL4311261 0.79 HTR1A (0.61) HTR1AADORA3CCKARHTR5AKMT2A
SCHEMBL13626630 0.79 HTR1A (0.61) HTR1AADORA3CCKARHTR5AKMT2A

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
WO-2009138416-A1 OXIME CARBAMOYL DERIVATIVES AS MODULATORS OF FATTY ACID AMIDES HYDROLASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-11-19 WO claimed
WO-2009138416-A1 OXIME CARBAMOYL DERIVATIVES AS MODULATORS OF FATTY ACID AMIDES HYDROLASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-11-19 WO disclosed