SCHEMBL1683445

SCHEMBL1683445

Cc1c(OC[C@@H](C)N)cn2ncnc(Nc3cnc4[nH]ccc4c3F)c12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.60
CYP3A4 P08684 6/20 0.40
FGFR1 P11362 5/20 0.40
STK10 O94804 2/20 0.40
MAP4K4 O95819 2/20 0.40
RET P07949 2/20 0.40
PDGFRB P09619 2/20 0.40
DDR1 Q08345 2/20 0.40
SLK Q9H2G2 2/20 0.40
KCNH2 Q12809 2/20 0.40
EPHB6 O15197 1/20 0.40
RIPK2 O43353 1/20 0.40
ABL1 P00519 1/20 0.40
EGFR P00533 1/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40
HCK P08631 1/20 0.40
KIT P10721 1/20 0.40
SRC P12931 1/20 0.40
PDGFRA P16234 1/20 0.40

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
SCHEMBL1683447 1.00 KDR (0.60) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683420 0.91 KDR (0.72) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683425 0.91 KDR (0.72) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683392 0.84 KDR (0.83) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683407 0.82 KDR (0.50) KDRCYP3A4KCNH2MKNK1MKNK2
SCHEMBL1683443 0.77 KDR (0.61) KDRCYP3A4FGFR1PDGFRBEGFR
SCHEMBL1683435 0.75 KDR (1.00) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683397 0.75 KDR (1.00) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683394 0.75 KDR (1.00) KDRCYP3A4FGFR1STK10MAP4K4
SCHEMBL1683473 0.74 KDR (0.67) KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539763-B1 AZAINDOLE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-04-13 EP claimed
EP-1539763-B1 AZAINDOLE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-04-13 EP disclosed