SCHEMBL31514345

SCHEMBL31514345

CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 8/20 0.47
▸ FNTB P49356 8/20 0.47
▸ CPB2 Q96IY4 3/20 0.42
▸ PGGT1B P53609 1/20 0.41
▸ FOLH1 Q04609 1/20 0.41
▸ FURIN P09958 2/20 0.41
▸ PRSS1 P07477 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
SCHEMBL29646168 0.93 FOLH1 (0.47) FNTAFNTBCPB2PGGT1BFOLH1
SCHEMBL31514363 0.89 CPB2 (0.43) CPB2FOLH1FURINPRSS1
SCHEMBL29591590 0.89 CPB2 (0.45) CPB2FOLH1FURIN
SCHEMBL29387202 0.88 FOLH1 (0.45) CPB2FOLH1FURINPRSS1
SCHEMBL29384713 0.88 FOLH1 (0.45) CPB2FOLH1FURINPRSS1
SCHEMBL4810020 0.87 FNTA (0.46) FNTAFNTBCPB2FURIN
SCHEMBL4810050 0.87 FNTA (0.46) FNTAFNTBCPB2FURIN
SCHEMBL31679318 0.87 FOLH1 (0.44) FNTAFNTBCPB2PGGT1BFOLH1
SCHEMBL4270994 0.86 FOLH1 (0.48) FNTAFNTBCPB2FOLH1
SCHEMBL4270981 0.86 FOLH1 (0.48) FNTAFNTBCPB2FOLH1

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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