SCHEMBL22540264

SCHEMBL22540264

CCCN[C@]1(c2ccccc2)CC[C@](CN(C)CC(C)(C)NC)(N(C=O)CC2CCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 15/20 0.41
▸ OPRL1 P41146 13/20 0.41

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
SCHEMBL19152761 0.75 OPRM1 (0.49) OPRM1OPRL1
SCHEMBL22540261 0.75 OPRM1 (0.46) OPRM1OPRL1
SCHEMBL21766728 0.72 OPRL1 (0.52) OPRM1OPRL1
SCHEMBL19153406 0.71 OPRM1 (0.53) OPRM1OPRL1
SCHEMBL19153829 0.68 OPRM1 (0.50) OPRM1OPRL1
SCHEMBL23316766 0.67 OPRL1 (0.42) OPRM1OPRL1
SCHEMBL19153839 0.67 OPRM1 (0.49) OPRM1OPRL1
SCHEMBL21766651 0.67 OPRL1 (0.49) OPRM1OPRL1
SCHEMBL22222298 0.66 GRIN2D (0.50) OPRM1OPRL1
SCHEMBL19148732 0.66 OPRM1 (0.54) OPRM1OPRL1

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
EP-3722283-A1 3-(CARBOXYETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2020-10-14 — — EP disclosed
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