SCHEMBL7477337

SCHEMBL7477337

O=C1c2ccccc2OC=CN1CCCCN1CCC=C(c2ncccn2)C1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.36
DRD3 P35462 2/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL7470642 0.86 SIGMAR1 (0.35) HTR1ADRD3
SCHEMBL7477190 0.84 DRD2 (0.42) HTR1ADRD3HTR7
SCHEMBL7467773 0.81 HTR1A (0.41) HTR1ADRD3HTR7
SCHEMBL7470769 0.81 HTR1A (0.41) HTR1ADRD3HTR7
SCHEMBL7469014 0.79 HTR1A (0.40) HTR1ADRD3HTR7
SCHEMBL7470315 0.79 HTR1A (0.61) HTR1ADRD3HTR7
SCHEMBL7466343 0.78 SIGMAR1 (0.37) HTR1ADRD3
SCHEMBL7670715 0.78 KCNH2 (0.56) HTR1ADRD3HTR7
SCHEMBL7464006 0.77 SIGMAR1 (0.53) HTR1ADRD3HTR7
SCHEMBL7467910 0.77 HTR1A (0.40) HTR1ADRD3

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