SCHEMBL31514366

SCHEMBL31514366

CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.50
▸ FNTA P49354 7/20 0.43
▸ FNTB P49356 7/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ PGGT1B P53609 2/20 0.41
▸ LAP3 P28838 3/20 0.40
▸ CTSD P07339 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL29709563 0.93 FOLH1 (0.44) FOLH1BACE1
SCHEMBL30051583 0.91 FOLH1 (0.51) FOLH1FNTAFNTBALDH1A1PGGT1B
SCHEMBL9622054 0.91 FOLH1 (0.58) FOLH1FNTAFNTBALDH1A1PGGT1B
SCHEMBL13093342 0.91 FOLH1 (0.58) FOLH1FNTAFNTBALDH1A1PGGT1B
SCHEMBL9622056 0.91 FOLH1 (0.58) FOLH1FNTAFNTBALDH1A1PGGT1B
SCHEMBL30051536 0.88 FOLH1 (0.56) FOLH1FNTAFNTBALDH1A1PGGT1B
SCHEMBL31432463 0.88 FOLH1 (0.48) FOLH1
SCHEMBL30262888 0.88 FNTA (0.52) FOLH1FNTAFNTBPGGT1BCTSD
SCHEMBL29539536 0.88 FOLH1 (0.48) FOLH1
SCHEMBL30052695 0.87 FOLH1 (0.55) FOLH1FNTAFNTBALDH1A1PGGT1B

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-119776332-A Enzymatic preparation process of histamine dihydrochloride 上海瀚鸿科技股份有限公司 2025-04-08 — — CN disclosed
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