SCHEMBL14293291

SCHEMBL14293291

Nc1ncnc2scc(O)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 11/20 0.53
MAP4K2 Q12851 11/20 0.53
KDR P35968 11/20 0.53
CLK4 Q9HAZ1 10/20 0.53
LCK P06239 9/20 0.53
CLK2 P49760 8/20 0.53
MET P08581 8/20 0.53
RPS6KA3 P51812 8/20 0.53
ROCK1 Q13464 8/20 0.53
RET P07949 6/20 0.53
GSK3B P49841 6/20 0.53
DYRK1A Q13627 6/20 0.53
CSF1R P07333 6/20 0.53
PRKD3 O94806 6/20 0.53
NTRK2 Q16620 6/20 0.53
NTRK3 Q16288 5/20 0.53
TAOK1 Q7L7X3 5/20 0.53
ABL1 P00519 5/20 0.53
NTRK1 P04629 5/20 0.53
FGFR1 P11362 5/20 0.53

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
SCHEMBL869609 0.78 KDR (0.54) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL3868631 0.76 MAP4K4 (0.57) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL14293148 0.72
SCHEMBL18590960 0.72 MAP4K4 (0.49) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL6926673 0.72 KDR (0.49) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL4488134 0.70 KDR (0.66) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL14013968 0.69 FGFR1 (1.00) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL4482587 0.68 KDR (0.62) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL14414209 0.67 MAP4K4 (0.63) MAP4K4MAP4K2KDRCLK4LCK
SCHEMBL900963 0.66 KDR (0.44) MAP4K4MAP4K2KDRCLK4LCK

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-2008018881-A1 6,6-BICYCLIC RING SUBSTITUTED SULFUR CONTAINING HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2008-02-14 WO disclosed