SCHEMBL3985665

SCHEMBL3985665

COc1cccc(CCc2cc(Nc3ccnc(NCCc4ccc(F)cn4)n3)[nH]n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 6/20 0.47
KDR P35968 5/20 0.47
FGFR1 P11362 5/20 0.47
INSR P06213 1/20 0.42
EGFR P00533 1/20 0.41
NTRK1 P04629 1/20 0.39
GRK6 P43250 2/20 0.38
AURKA O14965 1/20 0.38
GRK4 P32298 1/20 0.38
GRK5 P34947 1/20 0.38
GRK1 Q15835 1/20 0.38
GRK7 Q8WTQ7 1/20 0.38
KCNH3 Q9ULD8 1/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
CNR2 P34972 1/20 0.37
ROCK1 Q13464 1/20 0.37
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL4094616 0.84 JAK2 (0.51) IGF1RKDRFGFR1INSREGFR
SCHEMBL3985659 0.84 JAK2 (0.51) IGF1RKDRFGFR1INSREGFR
SCHEMBL3983403 0.81 IGF1R (0.67) IGF1RKDRFGFR1INSREGFR
SCHEMBL3934716 0.79 NR3C2 (0.44) IGF1RKDRFGFR1EGFRNTRK1
SCHEMBL3950749 0.79 IGF1R (0.67) IGF1RKDRFGFR1INSREGFR
SCHEMBL3981643 0.78 IGF1R (0.50) IGF1RKDRFGFR1INSREGFR
SCHEMBL3940507 0.78 IGF1R (0.66) IGF1RKDRFGFR1INSR
SCHEMBL4015520 0.77 IGF1R (0.54) IGF1RKDRFGFR1INSRNTRK1
SCHEMBL3932077 0.77 IGF1R (0.59) IGF1RKDRFGFR1INSRROCK1
SCHEMBL5096569 0.76 IGF1R (0.53) IGF1RKDRFGFR1INSRCLK4

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-2009056886-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF FGFR ACTIVITY ASTRAZENECA AB (SE) 2009-05-07 WO disclosed