SCHEMBL29174288

SCHEMBL29174288

Cc1cc(C#N)cc(C)c1CNc1cc(OCc2cn3cc(C4CC4)ccc3n2)nc(C(=O)O)n1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 17/20 0.38
▸ METTL3 Q86U44 2/20 0.37
▸ ENPP2 Q13822 1/20 0.34

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
SCHEMBL29958066 0.91 KLKB1 (0.36) KLKB1METTL3
SCHEMBL27033344 0.91 KLKB1 (0.36) KLKB1METTL3
SCHEMBL23088203 0.88 KLKB1 (0.39) KLKB1METTL3
SCHEMBL29174331 0.87 KLKB1 (0.38) KLKB1METTL3
SCHEMBL29957696 0.87 KLKB1 (0.38) KLKB1METTL3
SCHEMBL27033684 0.87 KLKB1 (0.38) KLKB1METTL3
SCHEMBL27033983 0.87 KLKB1 (0.37) KLKB1METTL3
SCHEMBL29958146 0.87 KLKB1 (0.37) KLKB1METTL3
SCHEMBL29958373 0.87 KLKB1 (0.35) KLKB1METTL3
SCHEMBL27033856 0.87 KLKB1 (0.35) KLKB1METTL3

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-117396474-A Plasma kallikrein inhibitors 武田药品工业株式会社 2024-01-12 — — CN disclosed
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