SCHEMBL31456866

SCHEMBL31456866

C[C@@H]1C[C@H](C(=O)Nc2cc(C(CCC3CC3)(N[S@+]([O-])C(C)(C)C)c3ccncc3)ccc2F)N(C(=O)O)C1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.56

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
SCHEMBL20584510 0.92 KLKB1 (0.54) KLKB1
SCHEMBL31456774 0.92 KLKB1 (0.54) KLKB1
SCHEMBL20584327 0.92 KLKB1 (0.54) KLKB1
SCHEMBL24012038 0.92 KLKB1 (0.54) KLKB1
SCHEMBL20446583 0.92 KLKB1 (0.54) KLKB1
SCHEMBL24569889 0.92 KLKB1 (0.54) KLKB1
SCHEMBL31456797 0.92 KLKB1 (0.54) KLKB1
SCHEMBL31456838 0.91 KLKB1 (0.57) KLKB1
SCHEMBL20584317 0.90 KLKB1 (0.45) KLKB1
SCHEMBL31456831 0.87 KLKB1 (0.44) KLKB1

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-114591212-B Human plasma kallikrein inhibitors 拜奥克里斯特制药公司 2025-01-28 — — CN disclosed
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