SCHEMBL7879446

SCHEMBL7879446

NC(=O)c1cccc(-c2cnc3[nH]cc(C(=O)c4cc(N)ccc4F)c3c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 4/20 0.58
NTRK1 P04629 3/20 0.58
DYRK1A Q13627 2/20 0.58
CDC7 O00311 1/20 0.58
PLK4 O00444 1/20 0.58
CHEK1 O14757 1/20 0.58
AURKA O14965 1/20 0.58
MAPK13 O15264 1/20 0.58
PDPK1 O15530 1/20 0.58
DYRK3 O43781 1/20 0.58
ROCK2 O75116 1/20 0.58
RPS6KA5 O75582 1/20 0.58
PRKD3 O94806 1/20 0.58
PAK4 O96013 1/20 0.58
CHEK2 O96017 1/20 0.58
ABL1 P00519 1/20 0.58
EGFR P00533 1/20 0.58
INSR P06213 1/20 0.58
LCK P06239 1/20 0.58
FYN P06241 1/20 0.58

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
SCHEMBL298672 0.94 AXL (0.52) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL413558 0.90 AXL (0.58) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL4570623 0.89 AXL (0.57) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL858764 0.89 AXL (0.58) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL858632 0.86 NTRK1 (0.64) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL20086218 0.85 DYRK1A (0.56) AXLNTRK1DYRK1APDPK1CDK2
SCHEMBL857559 0.85 KIT (0.54) AXLNTRK1DYRK1ARIPK1KIT
SCHEMBL298899 0.85 CAMKK2 (0.56) AXLPLK4RIPK1KITBRAF
SCHEMBL299603 0.84 CYP2C9 (0.53) AXLNTRK1DYRK1ACDC7PLK4
SCHEMBL858530 0.84 AXL (0.58) AXLNTRK1DYRK1ACDC7PLK4

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-2010129570-A1 SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS PLEXXIKON, INC. (US) 2010-11-11 WO disclosed