Vinylsulfonic Acid

Vinylsulfonic Acid

SCHEMBL3406586

C=CCc1cc(S(=O)(=O)O)ccc1C.C=CS(=O)(=O)O.C=Cc1cc(S(=O)(=O)O)ccc1C

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
TDP1 Q9NUW8 1/20 0.37
FFAR4 Q5NUL3 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
SNCA P37840 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALOX5 P09917 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL729517 0.89 POLB (0.57) POLBTDP1FFAR4GABRA1GABRB2
SCHEMBL167675 0.84 TDP1 (0.50) TDP1SNCAMEN1KMT2ATSHR
SCHEMBL10714072 0.77 TDP1 (0.66) TDP1SNCAPTGS2TSHR
Styrene SCHEMBL9742641 0.75 TDP1 (0.53) POLBTDP1SNCAMEN1KMT2A
Methacrylic Acid SCHEMBL10603121 0.75 TDP1 (0.41) TDP1SNCA
SCHEMBL8660346 0.75 POLB (0.57) POLBTDP1FFAR4GABRA1GABRB2
SCHEMBL561969 0.74 POLB (0.57) POLBFFAR4GABRA1GABRB2PTGS1
SCHEMBL6125446 0.74 POLB (0.53) POLBTDP1FFAR4GABRA1GABRB2
SCHEMBL1807695 0.73 ALDH1A1 (0.40) POLBTDP1SNCATSHR
SCHEMBL11264013 0.73 ALDH1A1 (0.39) POLBTDP1SNCAKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253376-B1 METHOD of PRODUCTION OF PARTICULATE WATER ABSORBENT COMPRISING WATER-ABSORBABLE RESIN AS MAIN INGREDIENT NIPPON CATALYTIC CHEM IND (JP) 2016-01-06 EP disclosed
EP-2253376-A1 METHOD FOR PRODUCTION OF PARTICULATE WATER ABSORBENT COMPRISING WATER-ABSORBABLE RESIN AS MAIN INGREDIENT Nippon Shokubai Co., Ltd. (JP) 2010-11-24 EP disclosed