SCHEMBL3362376

SCHEMBL3362376

Cc1ccc(N(C(N)=O)c2ccc(-c3cccc4c3c(N)nn4C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.57
FLT3 P36888 10/20 0.57
KIT P10721 8/20 0.55
CSF1R P07333 6/20 0.55
FLT1 P17948 5/20 0.55
FLT4 P35916 5/20 0.55
LCK P06239 4/20 0.55
BLK P51451 5/20 0.45
LYN P07948 4/20 0.45
DYRK3 O43781 3/20 0.45
ROCK2 O75116 3/20 0.45
MAP4K4 O95819 3/20 0.45
RET P07949 3/20 0.45
MET P08581 3/20 0.45
FGFR1 P11362 3/20 0.45
RPS6KB1 P23443 3/20 0.45
EPHA2 P29317 3/20 0.45
FRK P42685 3/20 0.45
CSNK1A1 P48729 3/20 0.45
CSNK1D P48730 3/20 0.45

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
SCHEMBL3362570 0.86 KDR (0.51) KDRFLT3KITCSF1RFLT1
SCHEMBL424772 0.81 KDR (0.84) KDRFLT3KITCSF1RFLT1
SCHEMBL13372660 0.76 KDR (0.67) KDRFLT3KITCSF1RFLT1
SCHEMBL422378 0.76 KDR (0.56) KDRFLT3KITCSF1RFLT1
SCHEMBL27812408 0.73 KDR (0.44) KDRFLT3KITCSF1RFLT1
SCHEMBL28760143 0.73 KDR (0.50) KDRFLT3KITCSF1RFLT1
SCHEMBL423300 0.73 KDR (1.00) KDRFLT3KITCSF1RFLT1
SCHEMBL422432 0.72 KDR (0.82) KDRFLT3KITCSF1RFLT1
SCHEMBL28871229 0.71 KDR (0.52) KDRFLT3KITCSF1RFLT1
SCHEMBL29968893 0.71 KDR (0.52) KDRFLT3KITCSF1RFLT1

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
EP-1638941-B1 INDAZOLE, BENZISOXAZOLE, AND BENZISOTHIAZOLE KINASE INHIBITORS ABBOTT LAB (US) 2010-06-02 EP claimed