SCHEMBL5072196

SCHEMBL5072196

COc1cc2ncnc(N3CCC(NC(=O)Cc4ccc(C(C)C)cc4)CC3I)c2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 15/20 0.51
PDGFRA P16234 9/20 0.51
FLT3 P36888 4/20 0.51
KIT P10721 2/20 0.51
ENPP1 P22413 2/20 0.46
FLT4 P35916 3/20 0.43
KDR P35968 2/20 0.43
CSF1R P07333 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPK1 P28482 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42

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
SCHEMBL4965829 0.87 PDGFRB (0.62) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4968153 0.85 PDGFRB (0.58) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4966832 0.74 PDGFRB (0.71) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4965795 0.72 PDGFRB (0.66) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4966763 0.72 ENPP1 (0.71) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4973701 0.71 MAPK7 (0.60) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL4972356 0.71 PDGFRB (0.66) PDGFRBPDGFRAFLT3KITENPP1
SCHEMBL14599423 0.70 PDGFRB (0.59) PDGFRBPDGFRAFLT3KITKDR
SCHEMBL2920107 0.70 PDGFRB (0.83) PDGFRBPDGFRAFLT3KIT
SCHEMBL5072193 0.70 PDGFRB (0.58) PDGFRBPDGFRAFLT3KITKDR

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-1893206-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-05 EP disclosed
WO-2006135636-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 WO disclosed