SCHEMBL12856430

SCHEMBL12856430

FCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCn1ccnc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.80
FBP1 P09467 1/20 0.61
KDR P35968 2/20 0.61
FGFR1 P11362 1/20 0.61
FLT1 P17948 1/20 0.61
CIT O14578 1/20 0.60
GAK O14976 1/20 0.60
EPHB6 O15197 1/20 0.60
ABCC4 O15439 1/20 0.60
DAPK3 O43293 1/20 0.60
RIPK2 O43353 1/20 0.60
NR1I2 O75469 1/20 0.60
RPS6KA4 O75676 1/20 0.60
STK17B O94768 1/20 0.60
STK10 O94804 1/20 0.60
PRKD3 O94806 1/20 0.60
ABCB11 O95342 1/20 0.60
MAP4K4 O95819 1/20 0.60
CHEK2 O96017 1/20 0.60
ABL1 P00519 1/20 0.60

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
SCHEMBL11683 0.93 EGFR (0.92) EGFRFBP1KDRFGFR1FLT1
SCHEMBL18979111 0.93 EGFR (0.92) EGFRFBP1KDRFGFR1FLT1
SCHEMBL11156 0.89 EGFR (1.00) EGFRFBP1KDRFGFR1FLT1
SCHEMBL17520362 0.89 EGFR (1.00) EGFRFBP1KDRFGFR1FLT1
SCHEMBL19220767 0.83 EGFR (0.76) EGFRKDRFGFR1FLT1CIT
SCHEMBL29577315 0.82 FBP1 (0.78) EGFRFBP1KDRERBB2FLT4
Hydrochloric Acid SCHEMBL2163107 0.81 EGFR (0.72) EGFRKDRFGFR1FLT1CIT
SCHEMBL15217652 0.80 FBP1 (0.78) EGFRFBP1KDRERBB2FLT4
SCHEMBL29577645 0.80 FBP1 (0.78) EGFRFBP1KDRERBB2FLT4
Hydrochloric Acid SCHEMBL7455695 0.80 FLT1 (0.91) EGFRKDRFGFR1FLT1FLT4

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-1364212-B1 THREE HYBRID ASSAY SYSTEM GPC BIOTECH AG (DE) 2011-02-02 EP disclosed