SCHEMBL29467320

SCHEMBL29467320

NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 6/20 0.48
▸ CTSB P07858 1/20 0.47
▸ OPRM1 P35372 2/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ PREP P48147 1/20 0.42
▸ FAP Q12884 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.42
▸ DPP9 Q86TI2 1/20 0.42
▸ F2 P00734 3/20 0.39
▸ NTMT1 Q9BV86 1/20 0.38
▸ OPRD1 P41143 1/20 0.37
▸ OPRK1 P41145 1/20 0.37

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
SCHEMBL28725262 0.89 OPRM1 (0.42) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL29101143 0.89 OPRM1 (0.42) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL28725265 0.89 OPRM1 (0.42) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL30139053 0.85 CAPN1 (0.42) CAPN1OPRM1DPP4PREPFAP
SCHEMBL29467319 0.84 FAP (0.48) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL18760229 0.84 CAPN1 (0.53) CAPN1CTSBOPRM1F2
SCHEMBL18942603 0.84 CAPN1 (0.44) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL31031470 0.83 CAPN1 (0.38) CAPN1CTSBOPRM1DPP4PREP
SCHEMBL26389253 0.82 DPP4 (0.40) OPRM1DPP4PREPFAPDPP8
SCHEMBL30138992 0.81 CAPN1 (0.40) CAPN1OPRM1DPP4PREPFAP

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-114315960-A Modified peptide, and cosmetic composition or medicinal composition and application thereof 深圳市维琪医药研发有限公司 2022-04-12 — — CN claimed
CN-114315960-A Modified peptide, and cosmetic composition or medicinal composition and application thereof 深圳市维琪医药研发有限公司 2022-04-12 — — CN disclosed
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