SCHEMBL8702137

SCHEMBL8702137

COc1ccccc1CCCCc1ccccc1OCC1CCCN(C)C1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.53
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
SIGMAR1 Q99720 2/20 0.49
KCNH2 Q12809 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
Hydrochloric Acid SCHEMBL27425800 0.99 HRH3 (0.52) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL27335891 0.95 HRH3 (0.55) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL27424650 0.95 HRH3 (0.55) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
Hydrochloric Acid SCHEMBL27405509 0.94 HRH3 (0.54) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
Hydrochloric Acid SCHEMBL27476351 0.94 HRH3 (0.54) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL8709024 0.90 CHRNB2 (0.48) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL8707213 0.89 CHRNB2 (0.48) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL8703661 0.89 CHRNB2 (0.48) HRH3CHRNB4CHRNA3SIGMAR1KCNH2
SCHEMBL8708774 0.88 HRH3 (0.48) HRH3MEN1KMT2A
SCHEMBL8706914 0.87 HRH3 (0.47) HRH3MEN1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0844000-A1 Use of alpha, omega-diarylalkane derivatives in the treatment and prevention of psychosis SANKYO COMPANY LIMITED (JP) 1998-05-27 EP claimed
US-5556864-A TREATMENT OF CIRCULATORY DISEASES AND PSYCHOSIS SANKYO COMPANY, LIMITED (JP) 1996-09-17 US claimed
EP-0600717-A1 Phenoxyalkylamines, -pyrrolidines and -piperidines for the treatment and prevention of circulatory diseases and psychosis SANKYO COMPANY LIMITED (JP) 1994-06-08 EP claimed
EP-0844000-A1 Use of alpha, omega-diarylalkane derivatives in the treatment and prevention of psychosis SANKYO COMPANY LIMITED (JP) 1998-05-27 EP disclosed
US-5556864-A TREATMENT OF CIRCULATORY DISEASES AND PSYCHOSIS SANKYO COMPANY, LIMITED (JP) 1996-09-17 US disclosed
CN-1102640-A Alpha, omega-diarylalkane derivatives, their preparation and their use in the treatment and prevention of circulatory and psychiatric disorders SANKYO CO (JP) 1995-05-17 CN disclosed
EP-0600717-A1 Phenoxyalkylamines, -pyrrolidines and -piperidines for the treatment and prevention of circulatory diseases and psychosis SANKYO COMPANY LIMITED (JP) 1994-06-08 EP disclosed