SCHEMBL30872271

SCHEMBL30872271

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

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 6/20 0.42
▸ BDKRB2 P30411 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ OPRM1 P35372 2/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ KEAP1 Q14145 2/20 0.39
▸ STAT3 P40763 2/20 0.38
▸ FAP Q12884 1/20 0.38

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
SCHEMBL30185030 0.93 BDKRB2 (0.46) CAPN1BDKRB2OPRM1OPRD1
SCHEMBL30872273 0.87 OPRM1 (0.44) CAPN1BDKRB2CTSBOPRM1OPRD1
SCHEMBL30872270 0.86 CAPN1 (0.53) CAPN1CTSBOPRM1OPRD1STAT3
SCHEMBL30872274 0.85 CAPN1 (0.47) CAPN1CTSBSTAT3
SCHEMBL30872264 0.84 CAPN1 (0.49) CAPN1CTSBOPRM1OPRD1
SCHEMBL30872272 0.83 CAPN1 (0.49) CAPN1CTSBSTAT3
SCHEMBL21637706 0.82 CAPN1 (0.40) CAPN1BDKRB2CTSBOPRM1OPRD1
SCHEMBL30872263 0.82 CAPN1 (0.54) CAPN1CTSBKEAP1STAT3
SCHEMBL21581703 0.81 CAPN1 (0.45) CAPN1BDKRB2CTSBOPRM1OPRD1
SCHEMBL26454162 0.81 CAPN1 (0.45) CAPN1BDKRB2CTSBOPRM1OPRD1

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-2024109878-A1 PEPTIDE HAVING ANTI-AGING EFFECT, AND COMPOSITION AND USE THEREOF 深圳市维琪科技股份有限公司 2024-05-30 — — WO claimed
WO-2024109878-A1 PEPTIDE HAVING ANTI-AGING EFFECT, AND COMPOSITION AND USE THEREOF 深圳市维琪科技股份有限公司 2024-05-30 — — WO disclosed
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