SCHEMBL5177296

SCHEMBL5177296

COc1cc2c(Nc3ccc(Br)cc3F)ccnc2cc1OCCn1ccnn1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.79
FGFR1 P11362 15/20 0.79
FLT1 P17948 15/20 0.79
EGFR P00533 12/20 0.79
FLT4 P35916 11/20 0.79
FGFR2 P21802 5/20 0.79
FGFR4 P22455 5/20 0.79
FGFR3 P22607 5/20 0.79
PDGFRB P09619 3/20 0.79
RET P07949 2/20 0.52
KIF5B P33176 2/20 0.52
GAK O14976 2/20 0.49
TEK Q02763 2/20 0.49
BMPR1B O00238 1/20 0.49
PLK4 O00444 1/20 0.49
CIT O14578 1/20 0.49
EPHB6 O15197 1/20 0.49
RIPK2 O43353 1/20 0.49
ROCK2 O75116 1/20 0.49
STK10 O94804 1/20 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
Zd-4190 Free Base SCHEMBL29729304 0.89 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
SCHEMBL14040728 0.89 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
Zd-4190 Free Base SCHEMBL173259 0.89 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
Zd-4190 Free Base SCHEMBL29363192 0.88 KDR (0.98) KDRFGFR1FLT1EGFRFLT4
SCHEMBL1894407 0.83 EGFR (0.70) KDRFGFR1FLT1EGFRFLT4
SCHEMBL16682500 0.78 EGFR (0.78) KDRFGFR1FLT1EGFRFLT4
SCHEMBL15445258 0.77 KDR (0.80) KDRFGFR1FLT1EGFRFLT4
SCHEMBL6477890 0.77 KDR (0.58) KDRFGFR1FLT1EGFRFLT4
SCHEMBL6431753 0.74 FLT1 (0.78) KDRFGFR1FLT1EGFRFLT4
SCHEMBL6097222 0.74 KDR (0.79) KDRFGFR1FLT1EGFRFLT4

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-1272186-B1 THERAPEUTIC COMBINATIONS OF ANTIHYPERTENSIVE AND ANTIANGIOGENIC AGENTS ASTRAZENECA AB (SE) 2007-02-28 EP claimed