SCHEMBL6004657

SCHEMBL6004657

Cc1cc(Oc2ccnc3ccc(F)cc23)c(-c2ccccn2)nc1C

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 11/20 0.57
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
MET P08581 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
CBFB Q13951 1/20 0.39
LMNA P02545 1/20 0.38
SRC P12931 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FFAR1 O14842 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
SCHEMBL6002965 0.89 TGFBR1 (0.49) TGFBR1KDM4ENPC1METAP2METAP1
SCHEMBL6005291 0.88 TGFBR1 (0.48) TGFBR1KDM4ENPC1SRC
SCHEMBL6004307 0.88 TGFBR1 (0.52) TGFBR1KDM4ENPC1LMNAL3MBTL1
SCHEMBL6004264 0.87 TGFBR1 (0.48) TGFBR1KDM4ENPC1SRC
SCHEMBL6004725 0.87 TGFBR1 (0.48) TGFBR1KDM4ENPC1CBFBSRC
SCHEMBL6004226 0.87 TGFBR1 (0.48) TGFBR1KDM4ENPC1METAP2METAP1
SCHEMBL6004134 0.86 KDM4E (0.52) TGFBR1KDM4ENPC1METAP2METAP1
SCHEMBL6004840 0.86 TGFBR1 (0.50) TGFBR1KDM4ENPC1CBFB
SCHEMBL6004154 0.86 TGFBR1 (0.47) TGFBR1KDM4ENPC1SRC
SCHEMBL6004185 0.86 TGFBR1 (0.59) TGFBR1KDM4ENPC1

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