SCHEMBL6619205

SCHEMBL6619205

Cn1ncc2cc3ncc(-c4ccc(Cl)s4)nc3cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.41
PDGFRA P16234 1/20 0.41
KIT P10721 1/20 0.41
FLT3 P36888 1/20 0.41
GRIN2B Q13224 6/20 0.38
GRIN1 Q05586 4/20 0.38
TRPM5 Q9NZQ8 1/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
FGFR3 P22607 3/20 0.37
KDR P35968 3/20 0.37
FGFR1 P11362 2/20 0.36
FGFR2 P21802 2/20 0.36
FGFR4 P22455 2/20 0.36
ALDH1A1 P00352 5/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL9052709 0.90 PDGFRB (0.38) PDGFRBPDGFRAKITFLT3GRIN2B
SCHEMBL6615006 0.77 PDGFRB (0.41) PDGFRBPDGFRAKITFLT3GRIN2B
SCHEMBL8887646 0.75 NPC1 (0.56) PDGFRBPDGFRAKITFLT3GRIN2B
SCHEMBL8499837 0.75 PDGFRB (0.53) PDGFRBPDGFRAGRIN2BGRIN1RAB9A
SCHEMBL6618710 0.74 PDGFRB (0.40) PDGFRBPDGFRAKITFLT3RAB9A
SCHEMBL8500901 0.74 PDGFRB (0.71) PDGFRBPDGFRARAB9ANPC1ALDH1A1
Hydrochloric Acid SCHEMBL8563702 0.74 PDGFRB (0.52) PDGFRBPDGFRAGRIN2BGRIN1RAB9A
Hydrochloric Acid SCHEMBL8562915 0.73 PDGFRB (0.69) PDGFRBPDGFRARAB9ANPC1ALDH1A1
SCHEMBL9132288 0.71 PDGFRB (0.40) PDGFRBPDGFRARAB9ANPC1FGFR3
SCHEMBL6617109 0.71 PDGFRB (0.40) PDGFRBPDGFRARAB9ANPC1FGFR3

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