SCHEMBL7469261

SCHEMBL7469261

Cc1ccc2c(c1)C(=O)N(CCCCN1CCCC(c3cccc(Cl)n3)C1)C(Cl)=CO2

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.37
DRD3 P35462 2/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
HRH1 P35367 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL7472354 0.91 DRD2 (0.37) HTR4DRD3DRD2DRD4HTR1A
SCHEMBL7466746 0.85 MEN1 (0.37) DRD3HTR1AHTR7HRH1HTR2B
SCHEMBL7466537 0.85 HTR7 (0.40) HTR4DRD3HTR1AHTR7HRH1
SCHEMBL7473223 0.85 HTR1A (0.41) DRD2HTR1A
SCHEMBL7474249 0.84 HTR4 (0.34) HTR4DRD3DRD2DRD1DRD4
SCHEMBL7471492 0.82 HTR1A (0.37) HTR4DRD3DRD2HTR1AHTR7
SCHEMBL7469271 0.80 DRD4 (0.46) DRD3DRD2DRD4HTR1AHTR7
SCHEMBL7471322 0.79 DRD2 (0.45) DRD2HTR1A
SCHEMBL7463900 0.79 DRD3 (0.36) DRD3DRD2DRD1DRD4DRD5
SCHEMBL7469687 0.78 DRD4 (0.44) DRD3DRD4HTR1AHTR7HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755930-B1 BENZOXAZEPINE DERIVATIVES, SALTS THEREOF, AND DRUGS CONTAINING THE SAME SUNTORY LTD (JP) 2002-07-31 EP disclosed
US-6337397-B1 A BENZOXAZEPINE DERIVATIVE FOR TREATMENT OF ANXIETY NEUROSIS, PHOBIAS, OBSESSIVE-COMPULSIVE DISORDERS, SCHIZOPHRENIA, POST-CARDIAC TRAUMA STRESS DISORDERS, DEPRESSION DISORDERS, PSYCHOSOMATIC DISORDERS AND OTHER PSYCHONEUROTIC DISORDERS, SUNTORY LIMITED (JP) 2002-01-08 US disclosed
US-6187769-B1 Benzoxazepine derivatives and their salts and medicaments containing the same SUNTORY LIMITED (JP) 2001-02-13 US disclosed
EP-0755930-A1 BENZOXAZEPINE DERIVATIVES, SALTS THEREOF, AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-01-29 EP disclosed