Phenylmethanesulfonic Acid

Phenylmethanesulfonic Acid

SCHEMBL16034286

O=S(=O)(O)Cc1ccccc1.[NaH].[NaH]

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.56
PRSS1 P07477 3/20 0.56
PRSS2 P07478 3/20 0.56
PRSS3 P35030 3/20 0.56
CA1 P00915 2/20 0.56
FAAH O00519 1/20 0.56
ELANE P08246 1/20 0.56
PRTN3 P24158 1/20 0.56
CA5A P35218 1/20 0.56
CA9 Q16790 1/20 0.56
MMP1 P03956 1/20 0.56
MMP2 P08253 1/20 0.56
MMP9 P14780 1/20 0.56
MMP8 P22894 1/20 0.56
MMP13 P45452 1/20 0.56
F2 P00734 2/20 0.50
HSP90AA1 P07900 1/20 0.50
KMT2A Q03164 1/20 0.48
TSHR P16473 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47

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
Phenylmethanesulfonic Acid SCHEMBL16034407 1.00 CA2 (0.56) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL589697 1.00 CA2 (0.56) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL27466862 0.98 CA2 (0.54) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL28294303 0.97 CA2 (0.58) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL1749 0.97 CA2 (0.58) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL127384 0.97 CA2 (0.58) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL30217949 0.97 CA2 (0.58) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL1073102 0.95 CA2 (0.56) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL9806419 0.95 CA2 (0.56) CA2PRSS1PRSS2PRSS3CA1
Phenylmethanesulfonic Acid SCHEMBL1739278 0.95 CA2 (0.56) CA2PRSS1PRSS2PRSS3CA1

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-2969210-A1 METHODS OF REMOVING CALCIUM MATERIAL FROM A SUBSTRATE OR CATALYTIC CONVERTER STEAG Energy Services GmbH (DE) 2016-01-20 EP disclosed
US-9061275-B2 Methods of removing calcium material from a substrate or catalytic converter STEAG ENERGY SERVICES GMBH (DE) 2015-06-23 US disclosed
WO-2014158378-A1 METHODS OF REMOVING CALCIUM MATERIAL FROM A SUBSTRATE OR CATALYTIC CONVERTER STEAG ENERGY SERVICES GMBH (DE) 2014-10-02 WO disclosed
US-20140274661-A1 METHODS OF REMOVING CALCIUM MATERIAL FROM A SUBSTRATE OR CATALYTIC CONVERTER STEAG ENERGY SERVICES GMBH (DE) 2014-09-18 US disclosed