SCHEMBL28660882

SCHEMBL28660882

CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(CCC(=O)O)C(=O)N2CC1CC1.[NaH]

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 20/20 0.84
▸ OPRL1 P41146 13/20 0.65

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
SCHEMBL19126222 0.99 OPRM1 (0.85) OPRM1OPRL1
SCHEMBL30455321 0.91 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19093955 0.91 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19111058 0.91 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19093954 0.91 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19094731 0.90 OPRM1 (0.82) OPRM1OPRL1
SCHEMBL19094733 0.90 OPRM1 (0.82) OPRM1OPRL1
SCHEMBL22540262 0.89 OPRM1 (0.82) OPRM1OPRL1
SCHEMBL19104845 0.87 OPRM1 (0.79) OPRM1OPRL1
SCHEMBL19111059 0.86 OPRM1 (0.75) 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
CN-108699005-B 3- (carboxyethyl) -8-amino-2-oxo-1, 3-aza-spiro- [4.5] -decane derivatives 格吕伦塔尔有限公司 2021-11-30 — — CN disclosed
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