SCHEMBL6005388

SCHEMBL6005388

Cc1cc(Oc2ccnc3cc(OCCO)ccc23)c(-c2ccccn2)nc1C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 16/20 0.48
MET P08581 1/20 0.40
MAOA P21397 1/20 0.39
TLR8 Q9NR97 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL6002895 0.92 TGFBR1 (0.48) TGFBR1MAOAKDM4ENPC1
SCHEMBL6004231 0.87 TGFBR1 (0.59) TGFBR1METKDM4ENPC1
SCHEMBL6004931 0.86 TGFBR1 (0.48) TGFBR1METMAOATLR8KDM4E
SCHEMBL3903240 0.85 TGFBR1 (0.49) TGFBR1MET
SCHEMBL6004761 0.85 TGFBR1 (0.49) TGFBR1MET
SCHEMBL6004802 0.85 TGFBR1 (0.48) TGFBR1METKDM4ENPC1
SCHEMBL6004261 0.84 TGFBR1 (0.48) TGFBR1TLR8KDM4ENPC1
SCHEMBL6005332 0.83 TGFBR1 (0.47) TGFBR1KDM4ENPC1
SCHEMBL6004158 0.82 RET (0.47) TGFBR1METTLR8KDM4ENPC1
SCHEMBL6004307 0.82 TGFBR1 (0.52) 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