SCHEMBL6004146

SCHEMBL6004146

Cc1ccc(Oc2ccnc3ccc(O)cc23)c(-c2ncccn2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.38
TGFBR1 P36897 5/20 0.38
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
KMT2A Q03164 1/20 0.35
RIPK2 O43353 2/20 0.35
SYK P43405 1/20 0.35
AURKB Q96GD4 1/20 0.35
INCENP Q9NQS7 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
KDR P35968 1/20 0.34
RET P07949 1/20 0.33

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
SCHEMBL6005330 0.87 TGFBR1 (0.46) SRCTGFBR1ALDH1A1KDM4EHPGD
SCHEMBL6004233 0.85 SRC (0.34) SRCTGFBR1ALDH1A1KDM4EHPGD
SCHEMBL6005361 0.85 TGFBR1 (0.38) SRCTGFBR1ALDH1A1KDM4EHPGD
SCHEMBL6004922 0.82 SLC22A12 (0.39) SRCTGFBR1ALDH1A1HSD17B10CASP1
SCHEMBL6004373 0.82 PDGFRB (0.55) SRCTGFBR1PDGFRBPDGFRA
SCHEMBL6004285 0.82 CYP3A4 (0.46) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL6005251 0.82 PDE2A (0.39) SRCTGFBR1ALDH1A1HSD17B10CASP1
SCHEMBL6005366 0.80 PDGFRB (0.36) SRCTGFBR1SYKAURKBINCENP
SCHEMBL6004262 0.80 ALDH1A1 (0.36) SRCTGFBR1ALDH1A1KDM4EHSD17B10
SCHEMBL6004162 0.80 ALDH1A1 (0.36) SRCTGFBR1ALDH1A1HSD17B10CASP1

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