SCHEMBL6004624

SCHEMBL6004624

COc1cc2nccc(Oc3cc4cnccc4nc3-c3cccnc3)c2cc1OC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.50
PDGFRA P16234 2/20 0.50
PDPK1 O15530 1/20 0.47
FGFR2 P21802 1/20 0.46
PDE10A Q9Y233 1/20 0.46
EGFR P00533 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL6004159 0.93 FGFR2 (0.52) PDGFRBPDGFRAFGFR2EGFRKDR
SCHEMBL3896885 0.92 PDGFRB (0.50) PDGFRBPDGFRAPDPK1FGFR2PDE10A
SCHEMBL6004787 0.86 PDGFRB (0.49) PDGFRBPDGFRAPDPK1FGFR2PDE10A
SCHEMBL3897825 0.85 SRC (0.50) PDGFRBPDGFRAPDPK1FGFR2PDE10A
SCHEMBL6004720 0.84 FGFR2 (0.52) PDGFRBPDGFRAFGFR2EGFRKDR
SCHEMBL3907943 0.84 PDGFRB (0.50) PDGFRBPDGFRAPDPK1FGFR2PDE10A
SCHEMBL3905966 0.83 PDE10A (0.51) PDGFRBPDGFRAPDPK1FGFR2PDE10A
SCHEMBL3904699 0.82 PDGFRB (0.52) PDGFRBPDGFRAFGFR2EGFR
SCHEMBL3895567 0.81 PDGFRB (0.49) PDGFRBPDGFRAFGFR2EGFRKDR
SCHEMBL6004173 0.81 PDGFRB (0.47) PDGFRBPDGFRAPDPK1FGFR2PDE10A

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-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed