SCHEMBL7083017

SCHEMBL7083017

O=C(/C=C/C(=O)OCc1cccc(Cl)c1Cl)OCc1cccc(Cl)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.53
MAPT P10636 2/20 0.48
HCAR2 Q8TDS4 4/20 0.48
PNMT P11086 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 2/20 0.43
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP12 P39900 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL7088966 1.00 IDO1 (0.53) IDO1MAPTHCAR2PNMTL3MBTL1
SCHEMBL7086104 0.86 L3MBTL1 (0.53) IDO1MAPTHCAR2L3MBTL1LMNA
SCHEMBL7089089 0.86 L3MBTL1 (0.53) IDO1MAPTHCAR2L3MBTL1LMNA
SCHEMBL9064620 0.86 L3MBTL1 (0.53) IDO1MAPTHCAR2L3MBTL1LMNA
SCHEMBL2345808 0.84 IDO1 (0.58) IDO1MAPTPNMTL3MBTL1MMP1
SCHEMBL4607557 0.84 IDO1 (0.58) IDO1MAPTPNMTL3MBTL1MMP1
SCHEMBL7756741 0.82 IDO1 (0.56) IDO1MAPTPNMTL3MBTL1MMP1
SCHEMBL722953 0.81 IDO1 (0.59) IDO1PNMTL3MBTL1LMNAMMP1
SCHEMBL13034147 0.81 IDO1 (0.55) IDO1MAPTPNMTL3MBTL1MMP1
SCHEMBL23293689 0.78 IDO1 (0.51) IDO1PNMTL3MBTL1MMP1MMP2

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-1331494-A1 COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PLASTIC LENS NOF CORPORATION (JP) 2003-07-30 EP disclosed