SCHEMBL5244544

SCHEMBL5244544

Cn1nccc1-c1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1OCCCC1CCNC1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 20/20 0.58
HTR2C P28335 18/20 0.58

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
SCHEMBL5245293 0.90 HTR2A (0.68) HTR2AHTR2C
SCHEMBL5244020 0.90 HTR2A (0.59) HTR2AHTR2C
SCHEMBL1865387 0.89 HTR2A (0.59) HTR2AHTR2C
SCHEMBL5243683 0.85 HTR2A (0.61) HTR2AHTR2C
SCHEMBL1166964 0.84 HTR2A (0.57) HTR2AHTR2C
SCHEMBL1166731 0.84 HTR2A (0.67) HTR2AHTR2C
SCHEMBL1165744 0.83 HTR2A (0.53) HTR2AHTR2C
SCHEMBL1166354 0.83 HTR2A (0.53) HTR2AHTR2C
SCHEMBL1165748 0.83 HTR2A (0.53) HTR2AHTR2C
SCHEMBL884146 0.83 HTR2A (0.66) HTR2AHTR2C

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-1833799-A2 3-PHENYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT-2a SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2007-09-19 EP disclosed
WO-2006055734-A2 3-PHENYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2006-05-26 WO disclosed