SCHEMBL3948265

SCHEMBL3948265

CC(=O)N1CCN(CCOc2ccc(NC(=O)COc3cccc(F)c3)cc2-c2ccnn2C)CC1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 20/20 0.77
KCNH2 Q12809 3/20 0.77
HTR2C P28335 12/20 0.65

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
SCHEMBL4034680 0.92 HTR2A (0.77) HTR2AKCNH2HTR2C
SCHEMBL4038273 0.92 HTR2A (0.70) HTR2AKCNH2HTR2C
SCHEMBL3952977 0.92 HTR2A (0.79) HTR2AKCNH2HTR2C
SCHEMBL4043408 0.92 HTR2A (0.78) HTR2AKCNH2HTR2C
SCHEMBL14385357 0.92 HTR2A (0.70) HTR2AKCNH2HTR2C
SCHEMBL3948999 0.91 HTR2A (0.72) HTR2AKCNH2HTR2C
SCHEMBL4044522 0.91 HTR2A (0.78) HTR2AKCNH2HTR2C
SCHEMBL4045042 0.90 HTR2A (0.78) HTR2AKCNH2HTR2C
SCHEMBL4351556 0.89 HTR2A (0.72) HTR2AKCNH2HTR2C
SCHEMBL14385334 0.88 HTR2A (0.67) HTR2AKCNH2HTR2C

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-2051978-A2 ACETAMIDE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2009-04-29 EP claimed
WO-2007136875-A2 ACETAMIDE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-11-29 WO claimed