SCHEMBL11164837

SCHEMBL11164837

c1ccc(CC2(Oc3ccccc3)CCN(CC3CCCCC3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 7/20 0.47
▸ OPRM1 P35372 6/20 0.47
▸ OPRK1 P41145 5/20 0.47
▸ SIGMAR1 Q99720 7/20 0.47
▸ OPRD1 P41143 2/20 0.45
▸ DRD2 P14416 3/20 0.44
▸ CCR5 P51681 1/20 0.43

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
SCHEMBL11153010 0.93 CYP2D6 (0.44) OPRL1OPRM1OPRK1SIGMAR1
SCHEMBL11151306 0.79 OPRL1 (0.54) OPRL1OPRM1SIGMAR1
SCHEMBL11149109 0.78 KDM4E (0.47) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL11155793 0.76 DRD2 (0.45) OPRL1OPRM1SIGMAR1DRD2
SCHEMBL11149158 0.75 MC4R (0.42) OPRL1OPRM1OPRK1SIGMAR1OPRD1
SCHEMBL11153729 0.75 SIGMAR1 (0.46) OPRL1OPRM1OPRK1SIGMAR1OPRD1
SCHEMBL11266008 0.75 DRD2 (0.37) OPRL1SIGMAR1DRD2
SCHEMBL11165081 0.75 CYP2D6 (0.50) CCR5
SCHEMBL11155212 0.74 OPRM1 (0.51) OPRL1OPRM1SIGMAR1DRD2
SCHEMBL11154795 0.73 DRD2 (0.40) OPRL1SIGMAR1DRD2

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
EP-0023706-B1 4-PHENOXY PIPERIDINES, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICAMENTS CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1983-03-02 — — EP disclosed
US-4333942-A Anti-depressant and analgesic 4-phenoxypiperidines BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-08 — — US disclosed
EP-0023706-A1 4-Phenoxy piperidines, process for their preparation, their use and medicaments containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1981-02-11 — — EP disclosed
Send feedback