SCHEMBL31257057

SCHEMBL31257057

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 11/20 0.58
▸ OPRM1 P35372 10/20 0.58
▸ OPRK1 P41145 2/20 0.55
▸ BACE1 P56817 2/20 0.48
▸ BACE2 Q9Y5Z0 1/20 0.48
▸ APC P25054 1/20 0.47

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
SCHEMBL31257019 0.91 OPRD1 (0.57) OPRD1OPRM1OPRK1BACE1
SCHEMBL31256964 0.90 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL31672201 0.90 OPRM1 (0.56) OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL31098023 0.90 OPRD1 (0.60) OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL30477365 0.89 OPRD1 (0.58) OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL29804763 0.89 OPRM1 (0.57) OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL31256991 0.88 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL31257082 0.87 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL30376274 0.87 OPRD1 (0.54) OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL31038686 0.87 OPRD1 (0.58) OPRD1OPRM1OPRK1BACE1BACE2

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
US-20240352445-A1 HUMANIZATION, AFFINITY MATURATION, AND OPTIMIZATION METHODS FOR PROTEINS AND ANTIBODIES ABWIZ BIO, INC. 2024-10-24 — — US disclosed
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