SCHEMBL5989863

SCHEMBL5989863

Cc1c[nH]c(C=C2C(=O)Nc3cccnc32)c1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.49
FGFR1 P11362 6/20 0.49
SRC P12931 4/20 0.49
NTRK1 P04629 3/20 0.49
NTRK3 Q16288 3/20 0.49
NTRK2 Q16620 3/20 0.49
RET P07949 3/20 0.49
FLT4 P35916 3/20 0.49
ALK Q9UM73 3/20 0.49
CDK2 P24941 3/20 0.49
GSK3B P49841 2/20 0.49
MEN1 O00255 2/20 0.49
AURKA O14965 2/20 0.49
PRKD3 O94806 2/20 0.49
MAP4K4 O95819 2/20 0.49
CHEK2 O96017 2/20 0.49
INSR P06213 2/20 0.49
LCK P06239 2/20 0.49
LYN P07948 2/20 0.49
MAPT P10636 2/20 0.49

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
SCHEMBL5988182 0.81 PDPK1 (0.41) KDRFGFR1SRCRETPDGFRB
SCHEMBL5988023 0.80 RET (0.64) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL6001450 0.79 KDR (0.63) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL6001449 0.79 KDR (0.63) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL5990287 0.78 PDGFRB (0.72) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL5989465 0.76 PDGFRB (0.55) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL15711681 0.74 NTRK1 (0.49) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL5989066 0.74 KDR (0.45) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL5988064 0.74 KDR (0.49) KDRFGFR1SRCNTRK1NTRK3
SCHEMBL5988039 0.73 KDR (0.51) KDRFGFR1SRCNTRK1NTRK3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6849641-B1 Azaindole tyrosine kinase inhibitors SUGEN, INC. (US) 2005-02-01 US claimed
US-6987113-B2 Tyrosine kinase inhibitors SUGEN, INC. (US) 2006-01-17 US disclosed
US-6849641-B1 Azaindole tyrosine kinase inhibitors SUGEN, INC. (US) 2005-02-01 US disclosed