SCHEMBL7094055

SCHEMBL7094055

CCN(CC)CC(O)CNC(=O)c1cn(C)c(CC=C2C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc32)c1-c1ccc(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.41
PDGFRB P09619 7/20 0.41
KIT P10721 4/20 0.41
GRK5 P34947 5/20 0.36
BACE1 P56817 1/20 0.35
CSF1R P07333 4/20 0.35
ABCB11 O95342 2/20 0.35
EGFR P00533 3/20 0.35
PRKAA1 Q13131 4/20 0.35
FLT3 P36888 4/20 0.35
PLK4 O00444 3/20 0.35
DCLK1 O15075 3/20 0.35
PDPK1 O15530 3/20 0.35
DAPK3 O43293 3/20 0.35
ROCK2 O75116 3/20 0.35
RPS6KA5 O75582 3/20 0.35
RPS6KA4 O75676 3/20 0.35
MAP4K4 O95819 3/20 0.35
CHEK2 O96017 3/20 0.35
NTRK1 P04629 3/20 0.35

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
SCHEMBL7089459 0.90 KDR (0.41) KDRPDGFRBKITGRK5CSF1R
SCHEMBL7094761 0.90 KDR (0.42) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4480902 0.81 KDR (0.52) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4480891 0.81 KDR (0.52) KDRPDGFRBKITGRK5CSF1R
SCHEMBL13712800 0.76 KDR (0.48) KDRPDGFRBKITGRK5BACE1
SCHEMBL4492209 0.72 GRK5 (0.56) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4492200 0.72 GRK5 (0.56) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4484698 0.70 KDR (0.58) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4484690 0.70 KDR (0.58) KDRPDGFRBKITGRK5CSF1R
SCHEMBL4495580 0.69 GRK5 (0.53) KDRPDGFRBKITGRK5CSF1R

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-1370554-A1 3-(4-AMIDOPYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS PROTEIN KINASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2003-12-17 EP claimed
WO-2002066463-A1 3-(4-AMIDOPYRROL-2-YLMETHLIDENE)-2-INDOLINONE DERIVATIVES AS PROTEIN KINASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2002-08-29 WO claimed