SCHEMBL6004293

SCHEMBL6004293

COc1cc2nccc(Oc3cc(C)c(C)nc3-c3ccccn3)c2cc1O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 11/20 0.52
SRC P12931 4/20 0.47
ATM Q13315 1/20 0.45
AXL P30530 1/20 0.41
MET P08581 1/20 0.41

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
SCHEMBL3900624 0.96 TGFBR1 (0.52) TGFBR1SRCAXL
SCHEMBL3898480 0.92 TGFBR1 (0.56) TGFBR1SRC
SCHEMBL6004942 0.89 TGFBR1 (0.55) TGFBR1SRC
SCHEMBL6004719 0.88 TGFBR1 (0.52) TGFBR1SRC
SCHEMBL6004708 0.88 TGFBR1 (0.52) TGFBR1SRCMET
SCHEMBL6004134 0.86 KDM4E (0.52) TGFBR1SRC
SCHEMBL6004790 0.86 TGFBR1 (0.47) TGFBR1SRCMET
SCHEMBL6004314 0.86 TGFBR1 (0.52) TGFBR1SRCAXL
SCHEMBL6004880 0.86 TGFBR1 (0.52) TGFBR1SRCMET
SCHEMBL3903240 0.85 TGFBR1 (0.49) TGFBR1SRCAXLMET

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