SCHEMBL7467448

SCHEMBL7467448

COc1ccc2c(c1)OC=C(CCl)N(CCCCN1CC=C(c3cncc(OC)n3)CC1)C2=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.37
DRD2 P14416 4/20 0.36
PARP1 P09874 2/20 0.36
HTR1A P08908 2/20 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
SCHEMBL7467230 0.87 SIGMAR1 (0.37) SIGMAR1DRD2PARP1HTR1A
SCHEMBL7473205 0.82 DRD2 (0.43) DRD2HTR1A
SCHEMBL7469351 0.80 DRD2 (0.42) DRD2PARP1HTR1A
SCHEMBL7466647 0.79 SIGMAR1 (0.44) SIGMAR1HTR1A
SCHEMBL7472345 0.78 PARP1 (0.41) SIGMAR1DRD2PARP1
SCHEMBL7473226 0.76 HTR6 (0.40) SIGMAR1DRD2PARP1HTR1A
SCHEMBL7467271 0.76 SIGMAR1 (0.48) SIGMAR1DRD2HTR1A
SCHEMBL7469800 0.75 SIGMAR1 (0.43) SIGMAR1DRD2HTR1A
SCHEMBL7471257 0.75 DRD2 (0.43) DRD2HTR1A
SCHEMBL7470457 0.74 DRD2 (0.47) DRD2HTR1A

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