SCHEMBL6900265

SCHEMBL6900265

CCOC(=O)C(C)=COc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.47
GPR35 Q9HC97 1/20 0.39
MAPT P10636 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
NPSR1 Q6W5P4 3/20 0.35
KDM4E B2RXH2 2/20 0.35
GLO1 Q04760 1/20 0.35
MEN1 O00255 1/20 0.35
S1PR4 O95977 1/20 0.35
S1PR1 P21453 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 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
SCHEMBL12851436 0.77 ABCB11 (0.48) MAPTSMN1; SMN2TDP1LMNAL3MBTL1
SCHEMBL12851395 0.72 LMNA (0.50) MAPTSMN1; SMN2LMNAGAAALDH1A1
SCHEMBL8956737 0.72 GABRA1 (0.48) ABCB1MAPTSMN1; SMN2TDP1LMNA
SCHEMBL8956730 0.72 GABRA1 (0.48) ABCB1MAPTSMN1; SMN2TDP1LMNA
SCHEMBL93317 0.70 MEN1 (0.51) MAPTTDP1LMNAGAAALDH1A1
SCHEMBL12851497 0.70 MEN1 (0.51) MAPTTDP1LMNAGAAALDH1A1
SCHEMBL12851453 0.70 DHODH (0.46) MAPTSMN1; SMN2LMNAL3MBTL1GAA
SCHEMBL12851505 0.70 SMN1; SMN2 (0.44) MAPTSMN1; SMN2TDP1LMNAL3MBTL1
SCHEMBL13130219 0.70 SMN1; SMN2 (0.44) MAPTSMN1; SMN2TDP1LMNAL3MBTL1
SCHEMBL13130213 0.69 ALDH1A1 (0.46) MAPTTDP1LMNAGAAALDH1A1

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
JP-2004315458-A METHOD FOR REFINING EPISULFIDE COMPOSITION MITSUI CHEMICALS INC 2004-11-11 JP disclosed