SCHEMBL31254508

SCHEMBL31254508

C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.61
▸ OPRD1 P41143 12/20 0.55
▸ OPRM1 P35372 6/20 0.55

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
SCHEMBL31575705 0.93 F2 (0.61) F2OPRD1OPRM1
SCHEMBL29421094 0.86 F2 (0.69) F2OPRD1OPRM1
SCHEMBL30443402 0.86 F2 (0.69) F2OPRD1OPRM1
SCHEMBL29679546 0.86 OPRD1 (0.60) F2OPRD1OPRM1
SCHEMBL31575698 0.86 F2 (0.56) F2OPRD1OPRM1
SCHEMBL29493717 0.84 NTSR2 (0.42) F2OPRD1OPRM1
SCHEMBL29421086 0.84 F2 (0.66) F2OPRD1OPRM1
SCHEMBL3221824 0.83 OPRK1 (0.56) F2OPRD1OPRM1
SCHEMBL31005429 0.82 OPRM1 (0.51) OPRD1OPRM1
SCHEMBL29421102 0.81 F2 (0.63) F2OPRD1OPRM1

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
WO-2024233936-A1 THROMBIN SENSITIVE PLATELET LIKE PARTICLES NORTH CAROLINA STATE UNIVERSITY (US) 2024-11-14 — — WO disclosed
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