SCHEMBL28065855

SCHEMBL28065855

Nc1cccc2cc(S(=O)(=O)O)c(S(=O)(=O)O)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.61
ALDH1A1 P00352 7/20 0.47
HSD17B10 Q99714 5/20 0.47
CASP6 P55212 4/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
TDP1 Q9NUW8 3/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TDP2 O95551 1/20 0.46
MAPT P10636 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
UBA2 Q9UBT2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
AURKA O14965 1/20 0.45
AURKB Q96GD4 1/20 0.45
PLAU P00749 2/20 0.44
F2 P00734 1/20 0.44

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
SCHEMBL6051270 0.91 TTR (0.59) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL14645367 0.87 TTR (0.61) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL8028868 0.82 TTR (0.52) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL29941351 0.81 ALDH1A1 (0.62) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL157169 0.81 ALDH1A1 (0.62) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL29518641 0.81 ALDH1A1 (0.62) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL7548396 0.81 TTR (0.55) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL28045820 0.81 TTR (0.57) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL28471751 0.80 ALDH1A1 (0.60) TTRALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL3246907 0.80 ALDH1A1 (0.60) TTRALDH1A1HSD17B10CASP6CYP2C9

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
CN-102566269-B Coloured composition, colour filter and display element JSR株式会社 2016-06-15 CN disclosed