Benzenethiol

Benzenethiol

SCHEMBL2363307

Nc1ccc(S)cc1.Sc1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
CYP3A4 P08684 4/20 0.52
TDP1 Q9NUW8 3/20 0.52
HSD17B10 Q99714 2/20 0.52
TAAR1 Q96RJ0 1/20 0.52
MAPT P10636 9/20 0.47
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
MAOB P27338 6/20 0.46
RAB9A P51151 6/20 0.46
MAOA P21397 5/20 0.46
ALDH1A1 P00352 5/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP2D6 P10635 1/20 0.46
PKM P14618 1/20 0.46

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
Benzene SCHEMBL21624953 0.94 MAPT (0.53) TSHRCYP3A4TDP1HSD17B10TAAR1
Aniline SCHEMBL8756429 0.91 TSHR (0.69) TSHRCYP3A4TDP1HSD17B10TAAR1
Benzenethiol SCHEMBL3715732 0.88 ACHE (0.59) TSHRCYP3A4TDP1HSD17B10TAAR1
SCHEMBL49836 0.87
Naphthalene SCHEMBL11355656 0.86 CYP3A4 (0.52) TSHRCYP3A4TDP1HSD17B10TAAR1
Benzenethiol SCHEMBL28801772 0.85 TSHR (0.46) TSHRCYP3A4TDP1HSD17B10TAAR1
4-Aminophenol SCHEMBL4163234 0.85 CYP3A4 (0.62) TSHRCYP3A4TDP1HSD17B10TAAR1
SCHEMBL5316147 0.84
Methane SCHEMBL747668 0.84
Water SCHEMBL28904254 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES GENFIT (FR) 2011-08-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES PPARD, PPARA, PPARG TSHR 318/4885CYP3A4 937/4885TDP1 4011/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.