SCHEMBL23269756

SCHEMBL23269756

Cc1cc(N)ncc1CNC(=O)c1ccnc(Cc2cc(C(N)=O)cc3cc(Cl)cnc23)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 19/20 0.70
▸ MAP4K1 Q92918 19/20 0.70

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
SCHEMBL23269773 0.89 KLKB1 (0.64) KLKB1MAP4K1
SCHEMBL23269772 0.88 KLKB1 (0.72) KLKB1MAP4K1
SCHEMBL23269761 0.88 KLKB1 (0.69) KLKB1MAP4K1
SCHEMBL23269768 0.88 KLKB1 (0.76) KLKB1MAP4K1
SCHEMBL17442531 0.87 KLKB1 (0.78) KLKB1MAP4K1
SCHEMBL20282808 0.86 KLKB1 (0.79) KLKB1MAP4K1
SCHEMBL17442527 0.82 KLKB1 (1.00) KLKB1MAP4K1
SCHEMBL16880516 0.81 KLKB1 (0.75) KLKB1MAP4K1
SCHEMBL23269770 0.81 KLKB1 (0.66) KLKB1MAP4K1
SCHEMBL23269758 0.81 KLKB1 (0.76) KLKB1MAP4K1

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
EP-3169325-B1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS INC (US) 2021-04-28 — — EP claimed
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