Benzenethiol

Benzenethiol

SCHEMBL28844149

Nc1cccc(S(=O)O)c1.Sc1ccccc1.[Zn]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.41
TDP1 Q9NUW8 4/20 0.39
MAOA P21397 4/20 0.38
CYP3A4 P08684 1/20 0.37
CASP1 P29466 1/20 0.37
RECQL P46063 1/20 0.37
ALDH1A1 P00352 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MAOB P27338 4/20 0.35
CYP19A1 P11511 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
Benzenethiol SCHEMBL28085213 0.98 PBRM1 (0.42) PBRM1TDP1MAOACYP3A4CASP1
SCHEMBL7621372 0.85 CYP3A4 (0.50) PBRM1TDP1MAOACYP3A4CASP1
SCHEMBL15345842 0.81
Aniline SCHEMBL17294827 0.77 TSHR (0.52) PBRM1TDP1MAOACYP3A4ALDH1A1
Benzenethiol SCHEMBL27818160 0.77 CYP3A4 (0.63) PBRM1TDP1MAOACYP3A4CASP1
SCHEMBL3161559 0.73 TSHR (0.46) TDP1MAOACYP3A4CASP1ALDH1A1
SCHEMBL10775693 0.72 HPGD (0.32) CYP3A4ALDH1A1CA12CA2CA9
SCHEMBL28286737 0.72 HPGD (0.41) TDP1CYP3A4RECQLALDH1A1CA12
SCHEMBL125011 0.72 HPGD (0.41) TDP1CYP3A4RECQLALDH1A1CA12
3-Aminophenol SCHEMBL4154412 0.72 TDP1 (0.71) PBRM1TDP1MAOACYP3A4CASP1

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
CN-105381573-B Golf 邓禄普体育用品株式会社 2018-03-09 CN disclosed
CN-103446724-B Golf 邓禄普体育用品株式会社 2018-01-19 CN disclosed
CN-103446720-B Golf ball 邓禄普体育用品株式会社 2017-05-10 CN disclosed