SCHEMBL31741305

SCHEMBL31741305

CSCC[C@H](NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 3/20 0.51
▸ FNTA P49354 1/20 0.49
▸ FNTB P49356 1/20 0.49
▸ LTA4H P09960 1/20 0.48
▸ SLC15A2 Q16348 1/20 0.46
▸ ITGB3 P05106 1/20 0.46
▸ ITGA2B P08514 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
SCHEMBL31501129 0.89 LTA4H (0.51) BACE1FNTAFNTBLTA4HSLC15A2
SCHEMBL30050877 0.87 LTA4H (0.60) FNTAFNTBLTA4H
SCHEMBL30063959 0.85 CHRNA1 (0.52) SLC15A2ITGB3ITGA2B
SCHEMBL29658158 0.84 MME (0.50) —
SCHEMBL27852469 0.83 MME (0.53) ITGB3ITGA2B
SCHEMBL27852467 0.83 MME (0.53) ITGB3ITGA2B
SCHEMBL29679654 0.83 OPRM1 (0.51) —
SCHEMBL31243863 0.83 HRH1 (0.49) BACE1SLC15A2
SCHEMBL30051473 0.82 LTA4H (0.64) FNTAFNTBLTA4H
SCHEMBL30916749 0.82 BACE1 (0.55) BACE1FNTAFNTB

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-121086009-A Novel polypeptide for regulating FABP activity and pharmaceutical application thereof 浙江国本医药集团有限公司 2025-12-09 — — CN disclosed
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