SCHEMBL31472819

SCHEMBL31472819

C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 5/20 0.50
▸ NMUR1 Q9HB89 5/20 0.50
▸ OPRM1 P35372 9/20 0.49
▸ OPRD1 P41143 3/20 0.49
▸ EPHA2 P29317 2/20 0.49
▸ OPRK1 P41145 6/20 0.48
▸ BDKRB2 P30411 1/20 0.47
▸ XIAP P98170 1/20 0.46
▸ F2 P00734 1/20 0.45

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
SCHEMBL30003633 0.86 EPHA2 (0.59) NMUR2NMUR1OPRM1OPRD1EPHA2
SCHEMBL29512235 0.84 OPRD1 (0.54) NMUR2NMUR1OPRM1OPRD1BDKRB2
SCHEMBL31119607 0.83 IL23R (0.54) NMUR2NMUR1F2
SCHEMBL31588354 0.83 OPRM1 (0.61) NMUR2NMUR1OPRM1EPHA2OPRK1
SCHEMBL30393693 0.83 OPRD1 (0.54) OPRM1OPRD1OPRK1BDKRB2F2
SCHEMBL31603932 0.83 NMUR2 (0.61) NMUR2NMUR1OPRM1OPRK1
SCHEMBL31603941 0.82 APLNR (0.45) NMUR2NMUR1OPRM1OPRK1
SCHEMBL12146086 0.82 NMUR2 (0.55) NMUR2NMUR1OPRM1OPRD1EPHA2
SCHEMBL12146087 0.82 NMUR2 (0.55) NMUR2NMUR1OPRM1OPRD1EPHA2
SCHEMBL29512206 0.81 CALCRL (0.49) OPRM1OPRD1OPRK1

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
CN-119775392-A Cholesterol ester transfer protein inhibitory peptide and preparation method and application thereof 渤海大学 2025-04-08 — — CN claimed
CN-119775392-A Cholesterol ester transfer protein inhibitory peptide and preparation method and application thereof 渤海大学 2025-04-08 — — CN disclosed
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