SCHEMBL7470360

SCHEMBL7470360

O=C1c2ccccc2OC=CN1CCCCN1CCC(c2ccccn2)CC1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
DRD2 P14416 4/20 0.40
DRD4 P21917 3/20 0.40
DRD3 P35462 3/20 0.40
HTR1A P08908 2/20 0.39
HTR2A P28223 1/20 0.39

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
SCHEMBL7467910 0.90 HTR1A (0.40) DRD2DRD3HTR1AHTR2A
SCHEMBL7475840 0.89 DRD4 (0.41) DRD4DRD3HTR1A
SCHEMBL7477921 0.86 DRD2 (0.50) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7473274 0.85 DRD2 (0.51) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7670715 0.82 KCNH2 (0.56) DRD2DRD3HTR1AHTR2A
SCHEMBL7470315 0.81 HTR1A (0.61) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7465422 0.81 HTR7 (0.38) DRD3HTR1A
SCHEMBL6169077 0.80 HTR1A (0.44) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7472750 0.78 DRD4 (0.42) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7464496 0.78 ADRA1D (0.45) ADRA1DADRA1AADRA1BDRD2DRD4

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