SCHEMBL31228813

SCHEMBL31228813

C[C@@H](O)[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.52
▸ OPRD1 P41143 3/20 0.52
▸ CASP3 P42574 2/20 0.51
▸ CASP7 P55210 1/20 0.51
▸ OPRK1 P41145 1/20 0.49
▸ KISS1R Q969F8 3/20 0.48
▸ BACE1 P56817 1/20 0.47
▸ BACE2 Q9Y5Z0 1/20 0.47
▸ CASP1 P29466 1/20 0.46
▸ CASP9 P55211 1/20 0.46
▸ ENPEP Q07075 3/20 0.45
▸ SLC6A2 P23975 1/20 0.44

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
SCHEMBL31366752 0.95 OPRM1 (0.55) OPRM1OPRD1CASP3CASP7OPRK1
SCHEMBL38662319 0.93 OPRD1 (0.53) OPRM1OPRD1CASP3CASP7OPRK1
SCHEMBL31134971 0.93 MME (0.47) OPRM1OPRD1OPRK1BACE1BACE2
SCHEMBL31257978 0.92 OPRD1 (0.57) OPRM1OPRD1OPRK1KISS1RSLC6A2
SCHEMBL29702198 0.90 OPRM1 (0.52) OPRM1OPRD1OPRK1KISS1R
SCHEMBL30055181 0.90 MME (0.49) OPRM1OPRD1OPRK1BACE1
SCHEMBL29960300 0.89 OPRD1 (0.52) OPRM1OPRD1CASP3CASP7OPRK1
SCHEMBL29860725 0.88 OPRM1 (0.53) OPRM1OPRD1CASP3CASP7OPRK1
SCHEMBL29993688 0.87 NAALAD2 (0.49) OPRM1OPRD1CASP3OPRK1KISS1R
SCHEMBL29860442 0.87 OPRD1 (0.59) OPRM1OPRD1OPRK1KISS1RBACE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4701649-A1 TREATMENT OF DIABETES MELLITUS Carmot Therapeutics Inc. (US) 2026-03-04 — — EP disclosed
WO-2024226540-A1 TREATMENT OF DIABETES MELLITUS CARMOT THERAPEUTICS INC. (US) 2024-10-31 — — WO disclosed
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