SCHEMBL3714740

SCHEMBL3714740

C=Cc1ccc(S(=O)(=O)O)cc1S(=O)(=O)O.[KH].[KH]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
SENP3 Q9H4L4 2/20 0.39
SENP2 Q9HC62 2/20 0.39
SENP1 Q9P0U3 2/20 0.39
SUMO2 P61956 1/20 0.39
SUMO1 P63165 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 4/20 0.39
CASP6 P55212 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAD1 O60671 1/20 0.38
P2RY6 Q15077 1/20 0.38
LMNA P02545 1/20 0.38
TIMP3 P35625 1/20 0.37
PKM P14618 1/20 0.36
TSHR P16473 3/20 0.36
NT5E P21589 2/20 0.36
KDM4E B2RXH2 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
SCHEMBL1502935 0.98 TDP1 (0.52) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL3789574 0.96 TDP1 (0.50) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL3719523 0.83 TDP1 (0.52) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL27894191 0.82 TDP1 (0.55) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL29396279 0.81 ALDH1A1 (0.41) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL225048 0.81 ALDH1A1 (0.41) TDP1SENP3SENP2SENP1SUMO2
Water SCHEMBL4381911 0.79 ALDH1A1 (0.41) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL2996002 0.79 ALDH1A1 (0.40) TDP1SENP3SENP2SENP1SUMO2
SCHEMBL11964335 0.79 TDP1 (0.52) TDP1ALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL4882745 0.79 ALDH1A1 (0.40) TDP1SENP3SENP2SENP1SUMO2

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
WO-2010135167-A1 COPOLYELECTROLYTE MONOMERS BEARING MULTIPLE ACID GROUPS ARKEMA INC. (US) 2010-11-25 WO disclosed