SCHEMBL8985608

SCHEMBL8985608

CN(Cc1ccc(OCc2ccc(Cl)cc2)cc1)CC1CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.51
APP P05067 1/20 0.49
MAOA P21397 3/20 0.47
FOXM1 Q08050 1/20 0.45
LSS P48449 2/20 0.45
NR4A2 P43354 1/20 0.44
CCR5 P51681 1/20 0.43
ACHE P22303 1/20 0.42

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
Oxalic Acid SCHEMBL8985649 0.93 HRH3 (0.52) MAOBMAOANR4A2
Hydrochloric Acid SCHEMBL8985560 0.86 MEN1 (0.48) MAOBMAOANR4A2CCR5ACHE
SCHEMBL8985602 0.86 MEN1 (0.48) MAOBMAOANR4A2CCR5ACHE
SCHEMBL9116935 0.81 MAOB (0.53) MAOBAPPMAOAFOXM1NR4A2
SCHEMBL8985627 0.79 CARM1 (0.68) CCR5
SCHEMBL8985631 0.78 MAOB (0.58) MAOBMAOANR4A2
SCHEMBL20314090 0.75 MEN1 (0.46) MAOBMAOANR4A2CCR5ACHE
SCHEMBL20314093 0.74 MEN1 (0.45) MAOBMAOALSSNR4A2ACHE
SCHEMBL10991891 0.74 MAOB (0.80) MAOBAPPMAOANR4A2
Maleic Acid SCHEMBL8985703 0.74 NR4A2 (0.47) MAOBMAOANR4A2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5550292-A ANXIOLYTIC AND ANTIDEPRESSANT AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 US claimed
EP-0666840-A1 BENZYLAMINE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-08-16 EP disclosed
WO-1995006630-A1 BENZYLAMINE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-03-09 WO disclosed