SCHEMBL7475840

SCHEMBL7475840

O=C1c2ccccc2OC=CN1CCCCN1CCCC(c2ccccn2)C1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.41
HTR7 P34969 2/20 0.37
HTR1A P08908 1/20 0.36
HRH1 P35367 1/20 0.36
DRD3 P35462 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL7465422 0.90 HTR7 (0.38) HTR7HTR1AHRH1DRD3HTR2B
SCHEMBL7470360 0.89 ADRA1D (0.42) DRD4HTR1ADRD3
SCHEMBL7469687 0.81 DRD4 (0.44) DRD4HTR7HTR1AHRH1DRD3
SCHEMBL7467910 0.81 HTR1A (0.40) HTR1ADRD3
SCHEMBL7670715 0.78 KCNH2 (0.56) HTR7HTR1ADRD3
SCHEMBL7470315 0.77 HTR1A (0.61) DRD4HTR7HTR1ADRD3
SCHEMBL7471947 0.77 DRD2 (0.41) HTR1A
SCHEMBL7477921 0.76 DRD2 (0.50) DRD4HTR7HTR1ADRD3
SCHEMBL7464006 0.76 SIGMAR1 (0.53) DRD4HTR7HTR1ADRD3HTR2B
SCHEMBL7473274 0.75 DRD2 (0.51) DRD4HTR1ADRD3

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