SCHEMBL16486531

SCHEMBL16486531

CCOC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3ccc(C(=O)N[C@@H](Cc4ccccc4)C(=O)OC)cc32)c1C

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.62
FGFR1 P11362 2/20 0.62
ABL1 P00519 1/20 0.62
RET P07949 1/20 0.62
FLT3 P36888 1/20 0.62
ALK Q9UM73 1/20 0.62
GRK5 P34947 16/20 0.57
PAK4 O96013 1/20 0.51
EGFR P00533 1/20 0.51
KDR P35968 1/20 0.51

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
SCHEMBL16568627 1.00 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16490721 1.00 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16490724 1.00 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16486408 1.00 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16486440 0.95 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16490719 0.95 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16568041 0.95 PDGFRB (0.62) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16490700 0.94 GRK5 (0.61) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16486943 0.94 GRK5 (0.61) PDGFRBFGFR1ABL1RETFLT3
SCHEMBL16486361 0.94 GRK5 (0.61) PDGFRBFGFR1ABL1RETFLT3

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
WO-2015022437-A1 INDOLINONE DERIVATIVES AS GRK5 MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-02-19 WO claimed
WO-2015022437-A1 INDOLINONE DERIVATIVES AS GRK5 MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-02-19 WO disclosed