SCHEMBL23269772

SCHEMBL23269772

Cc1nc(N)ccc1CNC(=O)c1ccnc(Cc2cc(C(N)=O)cc3cc(Cl)cnc23)c1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.72
▸ MAP4K1 Q92918 18/20 0.72

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
SCHEMBL23269758 0.93 KLKB1 (0.76) KLKB1MAP4K1
SCHEMBL23269746 0.91 KLKB1 (0.73) KLKB1MAP4K1
SCHEMBL23269750 0.89 KLKB1 (0.76) KLKB1MAP4K1
SCHEMBL23269773 0.89 KLKB1 (0.64) KLKB1MAP4K1
SCHEMBL23269756 0.88 KLKB1 (0.70) KLKB1MAP4K1
SCHEMBL23269763 0.88 KLKB1 (0.71) KLKB1MAP4K1
SCHEMBL23269765 0.88 KLKB1 (0.69) KLKB1MAP4K1
SCHEMBL23269762 0.88 KLKB1 (0.69) KLKB1MAP4K1
SCHEMBL17442546 0.87 KLKB1 (0.88) KLKB1MAP4K1
SCHEMBL17442692 0.86 KLKB1 (0.81) 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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