SCHEMBL13748612

SCHEMBL13748612

CN(C)c1ccc2c(=O)n(-c3cccc(-c4cc(Nc5ccn(C)c5)c(=O)n(C)c4)c3CO)ccc2c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.65
YES1 P07947 1/20 0.43
FGR P09769 1/20 0.43
TEC P42680 1/20 0.43
BMX P51813 1/20 0.43
KCNH2 Q12809 1/20 0.43
SLK Q9H2G2 1/20 0.43

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
SCHEMBL3207651 0.88 BTK (0.69) BTKYES1FGRTECBMX
SCHEMBL1726893 0.86 BTK (0.67) BTKYES1FGRTECBMX
SCHEMBL3199695 0.85 BTK (0.66) BTKYES1FGRTECBMX
SCHEMBL1727468 0.84 BTK (0.65) BTKYES1FGRTECBMX
SCHEMBL13139771 0.83 BTK (0.57) BTKYES1FGRTECBMX
SCHEMBL3214557 0.83 BTK (0.63) BTKYES1FGRTECBMX
SCHEMBL3210750 0.82 BTK (0.65) BTKYES1FGRTECBMX
SCHEMBL3220129 0.82 BTK (0.66) BTKYES1FGRTECBMX
SCHEMBL3207537 0.81 BTK (0.73) BTKYES1FGRTECBMX
SCHEMBL3207086 0.81 BTK (0.81) BTKYES1FGRTECBMX

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
WO-2009098144-A1 NOVEL PYRIDINONES AND PYRIDAZINONES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-13 WO disclosed