SCHEMBL6617430

SCHEMBL6617430

COc1ccc(-c2cnc3cc4cn(CCOC(C)=O)nc4cc3n2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.44
KIT P10721 5/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
FLT3 P36888 2/20 0.40
SYK P43405 1/20 0.40
GRIN2B Q13224 2/20 0.38
FGFR1 P11362 3/20 0.37
FGFR2 P21802 3/20 0.37
FGFR4 P22455 3/20 0.37
FGFR3 P22607 3/20 0.37
KDR P35968 3/20 0.37
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GLA P06280 2/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL6617110 1.00 MET (0.44) METKITPDGFRBPDGFRAFLT3
SCHEMBL6617433 0.87 PDGFRB (0.45) METKITPDGFRBPDGFRAFLT3
SCHEMBL6616314 0.87 PDGFRB (0.45) METKITPDGFRBPDGFRAFLT3
SCHEMBL6620856 0.85 KIT (0.44) KITPDGFRBPDGFRAFLT3SYK
SCHEMBL6616597 0.84 GRIN2B (0.41) KITPDGFRBPDGFRAFLT3GRIN2B
SCHEMBL6617943 0.84 PDGFRB (0.47) METKITPDGFRBPDGFRAFLT3
SCHEMBL6615937 0.83 PDGFRB (0.43) KITPDGFRBPDGFRAFLT3SYK
SCHEMBL9243880 0.83 FLT3 (0.42) KITPDGFRBPDGFRAFLT3SYK
SCHEMBL9241153 0.83 FLT3 (0.42) KITPDGFRBPDGFRAFLT3SYK
SCHEMBL6618914 0.82 GRIN2B (0.43) METKITPDGFRBPDGFRAFLT3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0779889-B1 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE AVENTIS PHARMA INC (US) 2004-06-23 EP disclosed
EP-0779889-A4 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE POULENC RORER PHARMA (US) 2000-02-23 EP disclosed
EP-0779889-A1 PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1997-06-25 EP disclosed
WO-1996007658-A1 PYRAZOLO[3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-03-14 WO disclosed
US-5476851-A Administering as therapeutic agents for various disease states which are characterized by uncontrolled cellular proliferation RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1995-12-19 US disclosed