SCHEMBL21766347

SCHEMBL21766347

CN(C)C1(c2ccccc2)CCC(CN(CC(=O)O)C(=O)NCC2CCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 20/20 0.48
▸ OPRL1 P41146 20/20 0.48

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
SCHEMBL19151440 0.87 OPRL1 (0.46) OPRM1OPRL1
SCHEMBL21766365 0.84 OPRL1 (0.46) OPRM1OPRL1
SCHEMBL21766632 0.83 OPRL1 (0.56) OPRM1OPRL1
SCHEMBL21766362 0.81 OPRL1 (0.56) OPRM1OPRL1
SCHEMBL22560734 0.81 OPRL1 (0.50) OPRM1OPRL1
SCHEMBL4702248 0.79 OPRL1 (0.55) OPRM1OPRL1
SCHEMBL25680098 0.79 OPRL1 (0.44) OPRM1OPRL1
SCHEMBL21766368 0.78 OPRL1 (0.54) OPRM1OPRL1
SCHEMBL19145436 0.77 OPRL1 (0.54) OPRM1OPRL1
SCHEMBL25678122 0.75 OPRL1 (0.60) 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-3402785-B1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2020-02-26 — — EP disclosed
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