SCHEMBL8415212

SCHEMBL8415212

CC(=O)CNS(=O)(=O)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
MEP1B Q16820 2/20 0.48
SLC1A3 P43003 1/20 0.47
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
KAT6A Q92794 1/20 0.46
ITGAV P06756 1/20 0.45
TBXAS1 P24557 2/20 0.44
CA9 Q16790 3/20 0.43
CA12 O43570 2/20 0.43
ALDH1A1 P00352 3/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
F13A1 P00488 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL7200209 0.87 PKM (0.51) PKMMEP1BSLC1A3SLC1A2SLC1A1
SCHEMBL7414871 0.86 ALDH1A1 (0.55) PKMMEP1BSLC1A3SLC1A2SLC1A1
SCHEMBL15548708 0.83 ALDH1A1 (0.53) PKMMEP1BSLC1A3SLC1A2SLC1A1
SCHEMBL2842146 0.83 MEP1B (0.68) PKMMEP1B
SCHEMBL5320463 0.82 ITGAV (0.51) PKMMEP1BSLC1A3SLC1A2SLC1A1
SCHEMBL27463180 0.81 ALDH1A1 (0.56) PKMMEP1BALDH1A1POLBTP53
SCHEMBL28398115 0.79 CA1 (0.49) SLC1A3SLC1A2SLC1A1KAT6AITGAV
SCHEMBL30194714 0.78 PKM (0.53) PKMSLC1A3SLC1A2SLC1A1CA9
SCHEMBL126986 0.78 PKM (0.53) PKMSLC1A3SLC1A2SLC1A1CA9
SCHEMBL11623415 0.77 TSHR (0.54) PKMCA9CA12ALDH1A1CA1

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-5990353-A DEMETALLIZING AN ARYLSULFONAMIDE ALKALI METAL SALT WITH AN AROMATIC ISOCYANATE COMPOUND IN AT LEAST ONE SOLVENT; USE AS A COLOR DEVELOPER FOR A THERMAL RECORDING MATERIAL WITH IMPROVED OIL RESISTANCE AND NONPLASTICIZED YAMAMOTO CHEMICALS, INC. (JP) 1999-11-23 US disclosed