Sugi Predict

Sugi Predict / Compounds / SCHEMBL30540072

SCHEMBL30540072

SCHEMBL30540072

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 10/20 0.50
▸ OPRK1 P41145 10/20 0.50
▸ EPHA2 P29317 4/20 0.48
▸ OPRD1 P41143 1/20 0.47
▸ NMUR2 Q9GZQ4 2/20 0.47
▸ NMUR1 Q9HB89 2/20 0.47
▸ ACE P12821 1/20 0.46
▸ F2 P00734 1/20 0.46

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
SCHEMBL29561225 0.91 PRCP (0.46) OPRM1OPRK1EPHA2NMUR2NMUR1
SCHEMBL29693015 0.89 OPRM1 (0.53) OPRM1OPRK1EPHA2NMUR2NMUR1
SCHEMBL29693008 0.89 OPRM1 (0.50) OPRM1OPRK1EPHA2NMUR2NMUR1
SCHEMBL9815799 0.87 OPRM1 (0.49) OPRM1OPRK1OPRD1F2
SCHEMBL29693016 0.87 OPRM1 (0.51) OPRM1OPRK1EPHA2NMUR2NMUR1
SCHEMBL30733269 0.84 EPHA2 (0.55) OPRM1OPRK1EPHA2OPRD1NMUR2
SCHEMBL29561678 0.84 CTRB1 (0.42) OPRM1OPRK1F2
SCHEMBL30150304 0.84 PTPN1 (0.49) —
SCHEMBL29797013 0.84 PTPN1 (0.49) —
SCHEMBL29384753 0.84 PTPN1 (0.49) —

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-116829169-B Synthetic peptides, compositions and uses thereof 深圳市维琪科技股份有限公司 2024-12-27 — — CN disclosed
CN-116829169-A Synthetic peptides, and cosmetic or pharmaceutical compositions and uses thereof 深圳市维琪科技股份有限公司 2023-09-29 — — CN disclosed
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