SCHEMBL10766959

SCHEMBL10766959

CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 10/20 0.44
▸ OPRM1 P35372 9/20 0.44
▸ OPRK1 P41145 3/20 0.44
▸ IL23R Q5VWK5 1/20 0.39
▸ CALCR P30988 4/20 0.38
▸ GLP1R P43220 1/20 0.38
▸ SCTR P47872 1/20 0.38
▸ GRPR P30550 1/20 0.37

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
SCHEMBL10766953 1.00 OPRD1 (0.44) OPRD1OPRM1OPRK1IL23RCALCR
SCHEMBL10767281 0.93 BACE1 (0.39) —
SCHEMBL10767275 0.93 BACE1 (0.39) —
SCHEMBL29431778 0.89 BACE1 (0.48) OPRD1OPRM1OPRK1IL23RCALCR
SCHEMBL30360222 0.84 OPRM1 (0.47) OPRD1OPRM1OPRK1CALCRGLP1R
SCHEMBL30438697 0.83 OPRM1 (0.46) OPRD1OPRM1OPRK1CALCRGLP1R
SCHEMBL30360225 0.83 OPRM1 (0.45) OPRD1OPRM1OPRK1CALCRGLP1R
SCHEMBL31257981 0.83 OPRD1 (0.44) OPRD1OPRM1OPRK1
SCHEMBL31241621 0.83 OPRD1 (0.44) OPRD1OPRM1OPRK1
SCHEMBL30360223 0.82 OPRM1 (0.45) OPRD1OPRM1OPRK1CALCRGLP1R

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-0222279-A2 Production of active proteins containing cystine residues Cangene Corporation (CA) 1987-05-20 — — EP disclosed
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