SCHEMBL20052474

SCHEMBL20052474

CCOCCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.79
PRKAA1 Q13131 8/20 0.79
PRKAA2 P54646 7/20 0.79
TLK2 Q86UE8 3/20 0.79
PDGFRB P09619 10/20 0.75
FGFR1 P11362 6/20 0.75
PLK4 O00444 2/20 0.75
DCLK1 O15075 2/20 0.75
PDPK1 O15530 2/20 0.75
DAPK3 O43293 2/20 0.75
ROCK2 O75116 2/20 0.75
RPS6KA5 O75582 2/20 0.75
RPS6KA4 O75676 2/20 0.75
MAP4K4 O95819 2/20 0.75
CHEK2 O96017 2/20 0.75
NTRK1 P04629 2/20 0.75
INSR P06213 2/20 0.75
LCK P06239 2/20 0.75
FYN P06241 2/20 0.75
FES P07332 2/20 0.75

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
SCHEMBL20051940 0.92 PRKAA1 (0.81) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL14047978 0.90 KDR (0.86) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL29856566 0.90 KDR (0.86) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL29773949 0.90 KDR (0.82) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL2115189 0.88 KDR (1.00) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL4453225 0.88 KDR (1.00) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL29766479 0.88 KDR (1.00) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL28435599 0.88 PRKAA1 (0.84) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL28435601 0.88 PRKAA1 (0.84) KDRPRKAA1PRKAA2TLK2PDGFRB
SCHEMBL28430885 0.88 KDR (0.86) KDRPRKAA1PRKAA2TLK2PDGFRB

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
US-9943605-B2 Polymer-semaxanib moiety conjugates NEKTAR THERAPEUTICS (US) 2018-04-17 US disclosed