SCHEMBL31257075

SCHEMBL31257075

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

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 13/20 0.52
▸ OPRM1 P35372 6/20 0.52
▸ OPRK1 P41145 1/20 0.52
▸ MME P08473 1/20 0.50
▸ ACE P12821 1/20 0.50
▸ CPA1 P15085 1/20 0.50
▸ ACE2 Q9BYF1 1/20 0.50
▸ GRB2 P62993 1/20 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
SCHEMBL31257078 0.93 OPRD1 (0.52) OPRD1OPRM1OPRK1MMEACE
SCHEMBL29448580 0.88 OPRD1 (0.61) OPRD1OPRM1OPRK1
SCHEMBL31648346 0.87 OPRD1 (0.60) OPRD1OPRM1OPRK1
SCHEMBL29364824 0.86 OPRD1 (0.61) OPRD1OPRM1OPRK1ACE
SCHEMBL29448576 0.85 OPRD1 (0.55) OPRD1OPRM1OPRK1
SCHEMBL31256976 0.84 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL32665682 0.84 CTSD (0.51) OPRD1OPRM1OPRK1MMEACE
SCHEMBL29448571 0.83 OPRD1 (0.61) OPRD1OPRM1OPRK1
SCHEMBL31257076 0.83 OPRD1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL29472198 0.83 OPRD1 (0.58) OPRD1OPRM1OPRK1MMEACE

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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