Thiobenzoic Acid

Thiobenzoic Acid

SCHEMBL2045958

C=Cc1ccc(C(O)=S)cc1.Cc1ccccc1.OC(=S)c1ccccc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
TSHR P16473 2/20 0.45
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39
ACHE P22303 1/20 0.39
PTGS2 P35354 1/20 0.39
EGFR P00533 2/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL28867765 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTDP1HPGDKMT2A
Thiobenzoic Acid SCHEMBL28198923 0.82 LMNA (0.58) ALDH1A1TSHRCES2CES1HPGD
Thiobenzoic Acid SCHEMBL8082926 0.81 ALDH1A1 (0.41) ALDH1A1TSHRCES2CES1HPGD
Thiobenzoic Acid SCHEMBL7582715 0.81 CES2 (0.56) ALDH1A1TSHRCES2CES1HPGD
Toluene SCHEMBL27694318 0.80 ALDH1A1 (0.62) ALDH1A1TSHRCES2CES1TP53
Thiobenzoic Acid SCHEMBL22325702 0.80 LMNA (0.55) ALDH1A1TSHRCES2CES1HPGD
Toluene SCHEMBL28506298 0.80 ALDH1A1 (0.57) ALDH1A1TSHRCES2CES1TP53
Styrene SCHEMBL28324278 0.78 ALDH1A1 (0.67) ALDH1A1TSHRCES2CES1TP53
Styrene SCHEMBL271801 0.78 ALDH1A1 (0.74) ALDH1A1TSHRTP53TDP1HPGD
Styrene SCHEMBL8859296 0.78 ALDH1A1 (0.74) ALDH1A1TSHRTP53TDP1HPGD

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-8883912-B2 Synthesis of arborescent polymers via controlled inimer-type reversible addition-fragmentation chain transfer (RAFT) polymerization UNIVERSITY OF AKRON (US) 2014-11-11 US disclosed
US-20110144268-A1 SYNTHESIS OF ARBORESCENT POLYMERS VIA CONTROLLED INIMER-TYPE REVERSIBLE ADDITION-FRAGMENTATION CHAIN TRANSFER (RAFT) POLYMERIZATION THE UNIVERSITY OF AKRON (US) 2011-06-16 US disclosed
WO-2010019563-A1 SYNTHESIS OF ARBORESCENT POLYMERS VIA CONTROLLED INIMER-TYPE REVERSIBLE ADDITION-FRAGMENTATION CHAIN TRANSFER (RAFT) POLYMERIZATION THE UNIVERSITY OF AKRON (US) 2010-02-18 WO disclosed