SCHEMBL9340571

SCHEMBL9340571

Cc1c(O)ccc(S(=O)(=O)c2ccc(O)c(C)c2C)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 1/20 0.42
RPS6KA3 P51812 1/20 0.40
ATM Q13315 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
PABPC1 P11940 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
PKM P14618 1/20 0.38
LDHA P00338 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
ALPL P05186 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
DNMT1 P26358 1/20 0.37
MCL1 Q07820 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
COMT P21964 2/20 0.37
TRPA1 O75762 1/20 0.36

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
SCHEMBL5155634 1.00 GAA (0.42) GAAALDH1A1HTTRPS6KA3ATM
SCHEMBL29599468 1.00 GAA (0.42) GAAALDH1A1HTTRPS6KA3ATM
SCHEMBL29381371 0.84 GAA (0.50) GAAALDH1A1RPS6KA3ATMMEN1
SCHEMBL13695530 0.84 RPS6KA3 (0.39) GAAALDH1A1HTTRPS6KA3ATM
SCHEMBL3376833 0.84 RPS6KA3 (0.46) GAAALDH1A1HTTRPS6KA3ATM
SCHEMBL23182558 0.81 TP53 (0.44) GAAALDH1A1HTTRPS6KA3ATM
SCHEMBL16201694 0.81 GAA (0.55) GAAALDH1A1RPS6KA3ATMMEN1
SCHEMBL30892518 0.80 PTGS1 (0.47) GAAALDH1A1HTTRPS6KA3KMT2A
SCHEMBL14658858 0.79 TRPA1 (0.50) GAAALDH1A1HTTATMMEN1
SCHEMBL8961421 0.79 ALDH1A1 (0.35) GAAALDH1A1HTTATMMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0325231-B1 Heat-sensitive recording material JUJO PAPER CO LTD (JP) 1994-06-22 EP disclosed
EP-0307836-B1 HEAT-SENSITIVE RECORDING MATERIAL JUJO PAPER CO., LTD. (JP) 1993-04-28 EP disclosed
EP-0325231-A2 Heat-sensitive recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1989-07-26 EP disclosed
EP-0307836-A2 Heat-sensitive recording material JUJO PAPER CO., LTD. (JP) 1989-03-22 EP disclosed