SCHEMBL7471767

SCHEMBL7471767

Cc1ccc2c(c1)OC=C(Cl)N(CCCCN1CCC(c3ncccn3)CC1)C2=O

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.39
DRD2 P14416 4/20 0.38
HTR2A P28223 3/20 0.38
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL7469636 0.92 HTR1A (0.39) HTR1ADRD2HTR2ADRD4DRD3
SCHEMBL7472225 0.91 HTR1A (0.41) HTR1ADRD2HTR2ADRD4DRD3
SCHEMBL7463900 0.90 DRD3 (0.36) HTR1ADRD2DRD4DRD3
SCHEMBL7470809 0.89 HTR1A (0.46) HTR1A
SCHEMBL7463219 0.88
SCHEMBL7473410 0.87 DRD2 (0.36) HTR1ADRD2HTR2ADRD4DRD3
SCHEMBL7466746 0.83 MEN1 (0.37) HTR1ADRD3
SCHEMBL7473722 0.82 HTR1A (0.39) HTR1ADRD2HTR2ADRD4DRD3
SCHEMBL7476895 0.82 DRD3 (0.37) HTR1ADRD2DRD4DRD3
SCHEMBL7471674 0.81 HTR1A (0.41) HTR1ADRD2HTR2A

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