SCHEMBL3272540

SCHEMBL3272540

O=S(=O)(c1ccsc1)c1ccsc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
EDNRA P25101 1/20 0.38
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
DAO P14920 1/20 0.37
HSD11B1 P28845 1/20 0.36
CYP3A4 P08684 3/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.36
MPO P05164 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 1/20 0.36
CCR4 P51679 1/20 0.34

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
SCHEMBL5482437 0.89 HTR6 (0.61) HTR6HSD11B1ALDH1A1TSHR
SCHEMBL15285333 0.85 GAA (0.64) L3MBTL1CYP3A4ALDH1A1CYP2C9GAA
SCHEMBL15285362 0.80 CA2 (0.48) HTR6L3MBTL1ALDH1A1GAA
SCHEMBL15287831 0.80 PKM (0.68) L3MBTL1HSD11B1ALDH1A1GAA
SCHEMBL11387848 0.79 L3MBTL1 (0.36) HTR6L3MBTL1CES2CES1EDNRA
SCHEMBL16795 0.79
SCHEMBL1035591 0.79
SCHEMBL6217014 0.79
SCHEMBL3437251 0.79
SCHEMBL1322510 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0302321-A2 Process for the preparation of thiophenols, and these thiophenols BAYER AG (DE) 1989-02-08 EP claimed
CN-111801355-B Polymer material and method for producing same 国立大学法人大阪大学 2023-02-28 CN disclosed
WO-2021045203-A1 POLYMER MATERIAL AND PRODUCTION METHOD THEREFOR 国立大学法人大阪大学 2021-03-11 WO disclosed
CN-111801355-A Polymer material and method for producing same 国立大学法人大阪大学 2020-10-20 CN disclosed
EP-1292308-B1 ALPHA,BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2010-06-09 EP disclosed
EP-1292308-A4 ALPHA,BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2005-09-14 EP disclosed
US-6599932-B1 Highly selective in killing tumor cells but not normal cells TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2003-07-29 US disclosed
US-20030130339-A1 ALPHA, BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS REDDY E PREMKUMAR (US) 2003-07-10 US disclosed
US-6541475-B2 2-nitrostyryl-1-(naphthylmethyl)sulfone for example TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2003-04-01 US disclosed
EP-1292308-A1 ALPHA,BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS Temple University of the Commonwealth System of Higher Education (US) 2003-03-19 EP disclosed
US-20020028818-A1 Alpha, beta-unsaturated sulfones for treating proliferative disorders TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2002-03-07 US disclosed
WO-2001078733-A1 ALPHA,BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2001-10-25 WO disclosed
US-4980510-A REACTING A SUBSTITUTED HALOBENZENE WITH SODIUM HYDROSULFIDE OR SODIUM SULFIDE AND ACIDIFICATION BAYER AKTIENGESELLSCHAFT (DE) 1990-12-25 US disclosed
EP-0302321-A2 Process for the preparation of thiophenols, and these thiophenols BAYER AG (DE) 1989-02-08 EP 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 (2 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-20020028818-A1 Alpha, beta-unsaturated sulfones for treating proliferative disorders QSOX1, CBR1, DEGS1 HTR6 2771/4885L3MBTL1 2727/4885CES2 2359/4885
US-20030130339-A1 ALPHA, BETA-UNSATURATED SULFONES FOR TREATING PROLIFERATIVE DISORDERS QSOX1, CCNY, CBR1 HTR6 3903/4885L3MBTL1 2056/4885CES2 2438/4885

“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.