Vinylsulfonic Acid

Vinylsulfonic Acid

SCHEMBL7860643

C=CS(=O)(=O)O.OCCN1CCNCC1

nearest known ligand 0.37

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
CXCR4 P61073 2/20 0.35
KDM4E B2RXH2 2/20 0.33
KMT2A Q03164 2/20 0.33
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
GABRA1 P14867 1/20 0.31
TSHR P16473 1/20 0.31
GABRG2 P18507 1/20 0.31
NFKB1 P19838 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31

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
Vinylsulfonic Acid SCHEMBL4897834 0.98 ALDH1A1 (0.35) POLBSMN1; SMN2HSD17B10ALDH1A1MAPT
Sulfuric Acid SCHEMBL28627994 0.87 POLB (0.39) POLBSMN1; SMN2HSD17B10ALDH1A1CXCR4
Sulfuric Acid SCHEMBL8846690 0.87 POLB (0.42) POLBSMN1; SMN2HSD17B10ALDH1A1CXCR4
SCHEMBL3862299 0.83 HSD17B10 (0.43) POLBSMN1; SMN2HSD17B10ALDH1A1CXCR4
Sulfuric Acid SCHEMBL29010960 0.83 POLB (0.39) POLBSMN1; SMN2HSD17B10ALDH1A1CXCR4
SCHEMBL83682 0.81 POLB (0.38) POLBSMN1; SMN2HSD17B10ALDH1A1MAPT
SCHEMBL28790654 0.81 POLB (0.38) POLBSMN1; SMN2HSD17B10ALDH1A1MAPT
SCHEMBL28478814 0.81 POLB (0.38) POLBSMN1; SMN2HSD17B10ALDH1A1CXCR4
Ethylene SCHEMBL28756284 0.80 POLB (0.46) POLBSMN1; SMN2HSD17B10ALDH1A1MAPT
SCHEMBL8373240 0.80 POLB (0.50) POLBSMN1; SMN2HSD17B10ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6306858-B1 ANTIINFLAMMATORY AGENTS FOR MUSCLE INFLAMMATION BY APPLING TO SKIN PUGLIESE PETER T (US) 2001-10-23 US disclosed
EP-1033913-A1 ZWITTERIONIC FATTY ACID COMPOUNDS FOR ANTI-INFLAMATION Pugliese, Peter T. (US) 2000-09-13 EP disclosed
WO-1999027791-A1 ZWITTERIONIC FATTY ACID COMPOUNDS FOR ANTI-INFLAMATION PUGLIESE PETER T (US) 1999-06-10 WO disclosed