SCHEMBL19414031

SCHEMBL19414031

COc1ccc(NC(=O)c2ccc(CN(C)C)cc2)c(C(=O)Nc2ccc(Cl)cn2)c1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.82
KLKB1 P03952 5/20 0.82
KCNH2 Q12809 2/20 0.75
F2 P00734 1/20 0.75

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
SCHEMBL2607614 0.86 F10 (0.80) F10KLKB1KCNH2F2
Betrixaban SCHEMBL158591 0.86 F10 (1.00) F10KCNH2F2
Betrixaban SCHEMBL29374026 0.86 F10 (1.00) F10KCNH2F2
SCHEMBL6110087 0.86 F10 (0.71) F10KLKB1KCNH2F2
SCHEMBL14996400 0.85 F10 (0.78) F10KLKB1KCNH2F2
SCHEMBL6109439 0.85 F10 (0.75) F10KLKB1KCNH2F2
SCHEMBL12132941 0.85 F10 (0.78) F10KLKB1KCNH2F2
Betrixaban SCHEMBL29858125 0.85 F10 (0.98) F10KCNH2F2
SCHEMBL6214943 0.85 F10 (0.72) F10KLKB1KCNH2F2
SCHEMBL22136974 0.85 F10 (0.83) F10KCNH2F2

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
US-9775890-B2 Factor Xa inhibitor used with liver-derived progenitor cells Université Catholique de Louvain (BE) 2017-10-03 US disclosed