SCHEMBL31437210

SCHEMBL31437210

N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 6/20 0.44
▸ ACE2 Q9BYF1 4/20 0.44
▸ OPRM1 P35372 6/20 0.43
▸ OPRK1 P41145 6/20 0.43
▸ PRCP P42785 1/20 0.43
▸ F2 P00734 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ EPHA2 P29317 2/20 0.42
▸ STAT6 P42226 1/20 0.41
▸ NMUR2 Q9GZQ4 1/20 0.41
▸ NMUR1 Q9HB89 1/20 0.41

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
SCHEMBL31437172 0.93 PRCP (0.44) ACEOPRM1OPRK1PRCPSTAT6
SCHEMBL31437183 0.92 PRCP (0.43) ACEOPRM1OPRK1PRCPF2
SCHEMBL31437213 0.92 APLNR (0.48) OPRM1OPRK1EPHA2
SCHEMBL31437182 0.92 F2 (0.41) ACEOPRM1OPRK1PRCPF2
SCHEMBL29561225 0.91 PRCP (0.46) OPRM1OPRK1PRCPF2PRSS1
SCHEMBL9815799 0.91 OPRM1 (0.49) OPRM1OPRK1PRCPF2PRSS1
SCHEMBL31437191 0.89 CTSL (0.50) OPRM1OPRK1
SCHEMBL31437193 0.89 PRCP (0.51) ACEACE2PRCP
SCHEMBL31467758 0.88 PRCP (0.46) ACEACE2OPRM1OPRK1PRCP
SCHEMBL31467771 0.86 PRCP (0.43) ACEOPRM1OPRK1PRCPF2

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
WO-2025037993-A1 DOSAGE FORM FOR PEPTIDE AGENTS MAJEWSKI FILIP (PL) 2025-02-20 — — WO disclosed
WO-2025037992-A1 NEW PEPTIDES AND USE THEREOF MAJEWSKI FILIP (PL) 2025-02-20 — — WO disclosed
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