SCHEMBL6004857

SCHEMBL6004857

CCc1ccc(Oc2ccnc3ccc(CC(=O)O)cc23)c(-c2ccccn2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.37
TGFBR1 P36897 3/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MET P08581 7/20 0.35
GAA P10253 1/20 0.35
PTGDR2 Q9Y5Y4 3/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDR P35968 3/20 0.35
MST1R Q04912 1/20 0.35

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
SCHEMBL6004082 0.84 CBFB (0.37) SRCTGFBR1MEN1KMT2AMET
SCHEMBL6004710 0.82 CYP3A4 (0.42) METKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6004984 0.80 PDE3B (0.39) SRCTGFBR1METGAAKDM4E
SCHEMBL6004207 0.80 CYP1A2 (0.37) TGFBR1MEN1KMT2AMETGAA
SCHEMBL6005438 0.80 MET (0.35) TGFBR1METKDM4EUSP2ALDH1A1
SCHEMBL6002914 0.79 PDGFRB (0.49) SRCTGFBR1METKDRMST1R
SCHEMBL6004277 0.79 NPSR1 (0.43) SRCTGFBR1KMT2AMETKDR
SCHEMBL6004278 0.78 KDR (0.49) SRCTGFBR1METKDR
SCHEMBL6004800 0.78 KDR (0.40) MEN1KMT2AMETGAAKDM4E
SCHEMBL6005260 0.76 MET (0.50) SRCTGFBR1METKDRMST1R

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