SCHEMBL31037794

SCHEMBL31037794

CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 8/20 0.55
▸ DPP3 Q9NY33 1/20 0.53
▸ OPRM1 P35372 3/20 0.52
▸ OPRD1 P41143 1/20 0.51
▸ CCKBR P32239 5/20 0.50

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
SCHEMBL30715835 0.85 TACR1 (0.58) DPP3OPRM1OPRD1CCKBR
SCHEMBL31037795 0.84 CTSL (0.57) CXCL8DPP3OPRM1OPRD1
SCHEMBL29812309 0.84 DPP3 (0.64) DPP3OPRM1
SCHEMBL30992101 0.81 DPP3 (0.59) DPP3OPRM1OPRD1CCKBR
SCHEMBL30051513 0.80 MEN1 (0.59) —
SCHEMBL31442253 0.79 CCKBR (0.56) CCKBR
SCHEMBL31442158 0.78 CCKBR (0.50) CCKBR
SCHEMBL23381025 0.78 OPRM1 (0.56) DPP3OPRM1OPRD1CCKBR
SCHEMBL14214936 0.78 TACR1 (0.63) OPRM1OPRD1
SCHEMBL31657628 0.78 GHSR (0.58) —

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
CN-118666951-A Fugu maculatus skin antioxidant collagen peptide for improving senile osteoporosis and preparation method and application thereof 浙江海洋大学 2024-09-20 — — CN disclosed
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