SCHEMBL9003443

SCHEMBL9003443

O=C(C[S+](c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
KMT2A Q03164 5/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.50
GSK3B P49841 4/20 0.47
MAPK1 P28482 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TRPA1 O75762 1/20 0.47
HIF1A Q16665 1/20 0.47
MEN1 O00255 4/20 0.46
HPGD P15428 3/20 0.46
HSD11B1 P28845 2/20 0.46
ALOX15 P16050 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL2404286 0.93 MAPT (0.56) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL1095578 0.87 TDP1 (0.54) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL11700905 0.83 MAPT (0.49) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL8855000 0.80 MAPT (0.47) MAPTL3MBTL1KMT2ANPC1RAB9A
Perchlorate SCHEMBL9003671 0.80 TDP1 (0.47) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL9003615 0.78 RAB9A (0.50) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL9003314 0.77 MAPT (0.44) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL11700913 0.76 MAPT (0.53) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL9003605 0.76 L3MBTL1 (0.40) MAPTL3MBTL1KMT2ANPC1RAB9A
SCHEMBL9003649 0.75 KMT2A (0.59) MAPTL3MBTL1KMT2ANPC1RAB9A

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
US-5500453-A INITIATOR FOR PHOTOSENSITIVE FREE RADICAL CURING/ POLYMERIZATION OF UNSATURATED COMPOUNDS TOYO INK MANUFACTURING CO., LTD. (JP) 1996-03-19 US disclosed