SCHEMBL5243165

SCHEMBL5243165

Cn1ncc(Br)c1-c1cc(C(N)=O)ccc1OCCC1CCCN1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 17/20 0.47
HTR2C P28335 16/20 0.47
CHEK2 O96017 1/20 0.44
SSTR2 P30874 1/20 0.42

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
SCHEMBL5247466 0.90 HTR2A (0.47) HTR2AHTR2CCHEK2SSTR2
SCHEMBL5243021 0.87 SSTR2 (0.50) HTR2AHTR2CCHEK2SSTR2
SCHEMBL5243079 0.86 HTR2A (0.44) HTR2AHTR2CSSTR2
SCHEMBL4698783 0.84 HTR2A (0.43) HTR2AHTR2CSSTR2
SCHEMBL5244246 0.83 HTR2A (0.62) HTR2AHTR2C
SCHEMBL5244245 0.83 HTR2A (0.62) HTR2AHTR2C
SCHEMBL5243204 0.83 HTR2A (0.46) HTR2AHTR2CCHEK2
SCHEMBL5244165 0.83 HTR2A (0.44) HTR2AHTR2CSSTR2
SCHEMBL5245690 0.83 HTR2A (0.54) HTR2AHTR2C
SCHEMBL4695702 0.82 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