SCHEMBL30429508

SCHEMBL30429508

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ OPRK1 P41145 1/20 0.48
▸ CMA1 P23946 1/20 0.45
▸ XIAP P98170 4/20 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
SCHEMBL30429187 0.83 CTRB1 (0.51) OPRM1OPRD1OPRK1CMA1
SCHEMBL24414220 0.81 CASP3 (0.43) CMA1
SCHEMBL30688543 0.79 CMA1 (0.55) CMA1
SCHEMBL30517416 0.79 ITGB3 (0.43) OPRD1
SCHEMBL24086707 0.79 PTPN1 (0.58) —
SCHEMBL29413333 0.78 CTRB1 (0.46) —
SCHEMBL30429182 0.77 GRB2 (0.44) —
SCHEMBL11947977 0.77 CTRB1 (0.55) OPRM1OPRD1OPRK1CMA1
SCHEMBL29868206 0.77 CTRB1 (0.56) OPRM1OPRD1OPRK1CMA1
SCHEMBL6434028 0.77 CTRB1 (0.56) OPRM1OPRD1OPRK1CMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4201951-B1 METHOD FOR PEPTIDE SYNTHESIS BACHEM HOLDING AG (CH) 2023-11-22 — — EP disclosed
WO-2023117904-A1 METHOD FOR PEPTIDE SYNTHESIS BACHEM HOLDING AG (CH) 2023-06-29 — — WO disclosed
EP-4201951-A1 METHOD FOR PEPTIDE SYNTHESIS Bachem Holding AG (CH) 2023-06-28 — — EP disclosed
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