SCHEMBL8022653

SCHEMBL8022653

COc1cccc(OC2CCC(O)(c3cccc(OC)c3)C(CN(C)C)C2)c1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.67
SLC6A4 P31645 8/20 0.67
OPRM1 P35372 5/20 0.67
OPRK1 P41145 5/20 0.67
OPRD1 P41143 5/20 0.67
SLC22A1 O15245 3/20 0.67
CHRM2 P08172 1/20 0.67
CHRM1 P11229 1/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67

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 SCHEMBL8616513 0.99 SLC6A2 (0.66) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL8026292 0.95 SLC6A2 (0.66) SLC6A2SLC6A4OPRM1OPRK1OPRD1
Hydrochloric Acid SCHEMBL8617567 0.94 SLC6A2 (0.65) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL28558378 0.85 OPRD1 (0.62) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL8023180 0.85 SLC6A2 (0.62) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL5630256 0.85 SLC6A2 (0.71) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL4663225 0.85 SLC6A2 (0.71) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL14503534 0.85 SLC6A2 (0.71) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL5626717 0.85 SLC6A2 (0.71) SLC6A2SLC6A4OPRM1OPRK1OPRD1
SCHEMBL4667239 0.85 OPRD1 (0.59) SLC6A2SLC6A4OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780369-B1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents GRUENENTHAL GMBH (DE) 2000-01-19 EP disclosed
EP-0780369-A1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents Grünenthal GmbH (DE) 1997-06-25 EP disclosed