SCHEMBL4041471

SCHEMBL4041471

COc1cc2c(cc1OCc1ccccc1)Cc1c-2n[nH]c1Nc1cccc(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 9/20 0.56
ABL1 P00519 1/20 0.56
LCK P06239 1/20 0.56
FYN P06241 1/20 0.56
FGFR1 P11362 1/20 0.56
SRC P12931 1/20 0.56
PDGFRA P16234 1/20 0.56
FLT1 P17948 1/20 0.56
FLT4 P35916 1/20 0.56
KDR P35968 1/20 0.56
CSNK1A1 P48729 1/20 0.56
CSNK1D P48730 1/20 0.56
CSNK1E P49674 1/20 0.56
GSK3A P49840 1/20 0.56
GSK3B P49841 1/20 0.56
CDK7 P50613 1/20 0.56
CSNK1G2 P78368 1/20 0.56
CSNK1G1 Q9HCP0 1/20 0.56
EIF2AK1 Q9BQI3 1/20 0.45
CHEK1 O14757 9/20 0.45

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
SCHEMBL4046881 1.00 PDGFRB (0.56) PDGFRBABL1LCKFYNFGFR1
SCHEMBL3090684 0.90 PDGFRB (0.67) PDGFRBABL1LCKFYNFGFR1
SCHEMBL13146236 0.90 PDGFRB (0.46) PDGFRBABL1LCKFYNFGFR1
Hydrochloric Acid SCHEMBL3083785 0.89 PDGFRB (0.66) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4042734 0.88 PDGFRB (0.52) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4049508 0.87 PDGFRB (0.57) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4040259 0.86 PDGFRB (0.56) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4043338 0.85 PDGFRB (0.53) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4046826 0.84 PDGFRB (0.54) PDGFRBABL1LCKFYNFGFR1
SCHEMBL4041132 0.84 PDGFRB (0.50) PDGFRBEIF2AK1CHEK1

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-1506175-B1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed