SCHEMBL11151306

SCHEMBL11151306

c1ccc(CN2CCC(Cc3ccccc3)(Oc3ccccc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 1/20 0.54
▸ CYP3A4 P08684 3/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ POLB P06746 2/20 0.53
▸ SIGMAR1 Q99720 9/20 0.52
▸ ALDH1A1 P00352 3/20 0.50
▸ CYP2D6 P10635 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ CYP2C9 P11712 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CCR3 P51677 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ OPRM1 P35372 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ GAA P10253 1/20 0.45

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 0.86 KDM4E (0.47) OPRL1POLBALDH1A1MEN1KMT2A
SCHEMBL11155793 0.84 DRD2 (0.45) OPRL1SIGMAR1MEN1KMT2AOPRM1
SCHEMBL11149158 0.83 MC4R (0.42) OPRL1SIGMAR1MEN1KMT2AOPRM1
SCHEMBL11153010 0.82 CYP2D6 (0.44) OPRL1SIGMAR1CYP2D6MEN1KMT2A
SCHEMBL11165081 0.82 CYP2D6 (0.50) CYP3A4CYP2D6USP2MAPK1CYP2C9
SCHEMBL11266008 0.82 DRD2 (0.37) OPRL1CYP3A4HSD17B10POLBSIGMAR1
SCHEMBL11155212 0.81 OPRM1 (0.51) OPRL1SIGMAR1ALDH1A1MEN1KMT2A
SCHEMBL11154795 0.80 DRD2 (0.40) OPRL1SIGMAR1CYP2D6MEN1KMT2A
SCHEMBL11164837 0.79 OPRL1 (0.47) OPRL1SIGMAR1OPRM1
SCHEMBL11155399 0.78 OPRL1 (0.58) OPRL1CYP3A4HSD17B10POLBSIGMAR1

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
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