SCHEMBL11247084

SCHEMBL11247084

CCC(C)N1CCC(Cc2ccccc2)(Oc2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ GAA P10253 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.39
▸ OPRM1 P35372 3/20 0.39
▸ OPRD1 P41143 3/20 0.39
▸ OPRK1 P41145 3/20 0.39
▸ OPRL1 P41146 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ POLB P06746 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
SCHEMBL11149109 0.80 KDM4E (0.47) MEN1KMT2AKDM4EALDH1A1OPRM1
SCHEMBL11149158 0.80 MC4R (0.42) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL11165081 0.80 CYP2D6 (0.50) MEN1KMT2ATSHR
SCHEMBL11155793 0.78 DRD2 (0.45) MEN1KMT2AOPRM1OPRL1
SCHEMBL11154795 0.77 DRD2 (0.40) MEN1KMT2AOPRL1
SCHEMBL11155212 0.76 OPRM1 (0.51) MEN1KMT2AALDH1A1OPRM1OPRL1
SCHEMBL11151306 0.76 OPRL1 (0.54) MEN1KMT2AGAAALDH1A1OPRM1
SCHEMBL11266008 0.74 DRD2 (0.37) MEN1KMT2AGAAALDH1A1OPRL1
SCHEMBL11150812 0.71 RAB9A (0.41) KMT2AGAAOPRM1LMNAMAPT
SCHEMBL11153010 0.71 CYP2D6 (0.44) MEN1KMT2AKDM4EOPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4333942-A Anti-depressant and analgesic 4-phenoxypiperidines BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-08 — — US disclosed
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