Thiobenzoic Acid

Thiobenzoic Acid

SCHEMBL5007779

C#N.CCCCc1ccccc1C(O)=S.OC(=S)c1ccccc1

nearest known ligand 0.38

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
PTGS2 P35354 1/20 0.36
KMT2A Q03164 1/20 0.35
CES2 O00748 3/20 0.35
CES1 P23141 3/20 0.35
HTT P42858 1/20 0.34
SLC16A3 O15427 1/20 0.34
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33
BCL2L1 Q07817 2/20 0.33
BAK1 Q16611 2/20 0.33
KAT8 Q9H7Z6 2/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
EP300 Q09472 1/20 0.33
KAT2A Q92830 1/20 0.33
KAT2B Q92831 1/20 0.33

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
Thiobenzoic Acid SCHEMBL28533220 0.94 LIPG (0.40) LIPGCYP3A4CYP2D6CYP2C9PTGS2
Thiobenzoic Acid SCHEMBL2457293 0.91 KMT2A (0.37) KMT2ACES2CES1HTTPPARG
SCHEMBL9791249 0.89 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9KMT2A
Thiobenzoic Acid SCHEMBL28627894 0.85 KMT2A (0.39) KMT2ACES2CES1HTTPPARG
SCHEMBL2453233 0.84 LIPG (0.53) LIPGPTGS2BIDMCL1BCL2L1
SCHEMBL9489170 0.83 LIPG (0.41) LIPGCYP3A4CYP2D6CYP2C9PTGS2
SCHEMBL10384517 0.82 LIPG (0.51) LIPGPTGS2BIDMCL1BCL2L1
SCHEMBL11570756 0.82 LIPG (0.56) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL11569407 0.82 LIPG (0.56) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL9456052 0.82 LIPG (0.56) LIPGBIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776399-B1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIV GENT (BE) 2012-11-14 EP claimed
EP-3018151-A1 PROCESS FOR PREPARING INERT RAFT POLYMERS Universiteit Gent (BE) 2016-05-11 EP disclosed
US-20130096268-A1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIVERSITEIT GENT (BE) 2013-04-18 US disclosed
EP-1776399-B1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIV GENT (BE) 2012-11-14 EP disclosed
US-20080262160-A1 Monodisperse Polymers Containing (Alkyl)Acrylic Acid Moieties, Precursors and Methods for Making them and their Applications UNIVERSITEIT GENT (BE) 2008-10-23 US disclosed
EP-1776399-A1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIVERSITEIT GENT (BE) 2007-04-25 EP disclosed
WO-2006002496-A1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIVERSITEIT GENT (BE) 2006-01-12 WO disclosed