SCHEMBL4660667

SCHEMBL4660667

COc1ncc(N)cc1-c1c(Cl)cnn1C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 13/20 0.40
HTR2C P28335 7/20 0.40
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
RORC P51449 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL4659261 0.83 HTR2A (0.40) HTR2AHTR2C
SCHEMBL4660541 0.78 HTR2A (0.39) HTR2AHTR2CKMT2AALDH1A1KDM4E
SCHEMBL3947106 0.77 HTR2A (0.57) HTR2AHTR2CKMT2A
SCHEMBL4659255 0.72 DRD1 (0.40) HTR2AHTR2CALDH1A1CYP1A2CYP3A4
SCHEMBL115753 0.72 TSHR (0.41) KMT2AALDH1A1KDM4ECYP1A2CYP3A4
SCHEMBL4660710 0.71 HTR2A (0.74) HTR2AHTR2C
SCHEMBL4661872 0.71 HTR2A (0.63) HTR2AHTR2C
SCHEMBL4659253 0.71 HTR2A (0.58) HTR2AHTR2CCYP1A2CYP3A4CYP2C19
SCHEMBL2064595 0.71 CA1 (0.44) HTR2AHTR2CKMT2AALDH1A1KDM4E
SCHEMBL4660702 0.70 HTR2A (0.52) HTR2AHTR2CKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004627-A2 3-PYRIDINYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP claimed
WO-2007120600-A2 3-PYRIDINYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO claimed
EP-2004627-A2 3-PYRIDINYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP disclosed
WO-2007120600-A2 3-PYRIDINYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed
WO-2007120600-A2 3-PYRIDINYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed