SCHEMBL7465146

SCHEMBL7465146

COc1ccc2c(c1)OC=CN(CCCCN1CCC(c3ncc(F)c(N)n3)CC1)C2=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.37
MAOB P27338 1/20 0.35
KCNH2 Q12809 1/20 0.35
PDE6D O43924 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 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
SCHEMBL7473384 0.87 HTR1A (0.38) DRD2HTR2AHTR2C
SCHEMBL7477921 0.79 DRD2 (0.50) DRD2HTR2AHTR2C
SCHEMBL7471601 0.78 DRD2 (0.39) DRD2KCNH2HTR2A
SCHEMBL7473274 0.78 DRD2 (0.51) DRD2PDE6DHTR2AHTR2C
SCHEMBL7469328 0.77 HTR1A (0.37)
SCHEMBL7471947 0.77 DRD2 (0.41) DRD2MAOB
SCHEMBL7469706 0.76 DRD2 (0.34) DRD2PDE6DHTR2A
SCHEMBL7477641 0.75 DRD2 (0.48) DRD2MAOB
SCHEMBL7468538 0.73 HTR1A (0.55) KCNH2HTR2AHTR2C
SCHEMBL7473493 0.72 MAOB (0.36) MAOB

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