SCHEMBL542839

SCHEMBL542839

Cc1ccc(S(=O)(=O)OCC#CC#CCOS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
STAT3 P40763 1/20 0.42
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
VDR P11473 1/20 0.40
ENPP3 O14638 2/20 0.40
ENPP1 P22413 2/20 0.40
ENPP2 Q13822 2/20 0.40
TLR9 Q9NR96 1/20 0.39

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
SCHEMBL11133439 0.95 STAT3 (0.40) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL7644858 0.92 GAA (0.46) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL2360932 0.92 STAT3 (0.41) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL11142877 0.88 ENPP3 (0.36) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL4801283 0.87 CYP1A2 (0.44) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL7457487 0.86 GAA (0.41) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL1603835 0.86 GAA (0.41) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL16344942 0.86 GAA (0.41) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL7456678 0.86 GAA (0.41) GAASTAT3ALDH1A1CYP3A4CYP2C9
SCHEMBL7581349 0.84 CA12 (0.50) GAASTAT3ALDH1A1CYP3A4CYP2C9

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 145 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114182528-B Fibrilia with antibacterial and deodorizing functions and preparation method thereof 青岛尼希米生物科技有限公司 2024-01-09 CN claimed
CN-114182528-A Fibrilia with antibacterial and deodorizing functions and preparation method thereof 青岛尼希米生物科技有限公司 2022-03-15 CN claimed
US-8529682-B2 Process for preparing an indicator composition and indicator compositions TEMPTIME CORPORATION (US) 2013-09-10 US claimed
EP-1048476-B1 Time-temperature medium and use NCR INT INC (US) 2005-10-12 EP claimed
US-6524000-B1 A recording material comprising a base sheet suitable for feeding into a thermal printer, wherein said thermal printer is suitable for generating a thermal image on thermal paper, NCR CORPORATION 2003-02-25 US claimed
US-6517239-B1 Time-temperature indicators activated with thermal transfer printing and methods for their production NCR CORPROATION 2003-02-11 US claimed
EP-1048477-A1 Time-temperature indicators activated with direct thermal printing and methods for their production NCR INTERNATIONAL INC. (US) 2000-11-02 EP claimed
EP-1048476-A1 Time-temperature indicators activated with thermal transfer printing and methods for their production NCR INTERNATIONAL INC. (US) 2000-11-02 EP claimed
US-4389217-A IRREVERSIBLE END-POINT COLOR AFTER POLYMERIZATION OF A CONJUGATED DIYNE MOMONER ALLIED CORPORATION (US) 1983-06-21 US claimed
US-4189399-A UNDERGOES COLOR CHANGE WHEN EXPOSED TO ACTINIC RADIATION OR ANNEALING ALLIED CHEMICAL CORPORATION (US) 1980-02-19 US claimed
JP-2160697-A None JP disclosed
CN-122071667-A Trichoderma reesei engineering strain and preparation method and application thereof 大连理工大学 2026-05-22 CN disclosed
US-12625441-B2 Electrostatic charge image developing toner and image forming method Konica Minolta, Inc. (JP) 2026-05-12 US disclosed
EP-3452822-B1 A TIME-TEMPERATURE INDICATOR BASED ON INCREASED THERMAL REACTIVITY OF A DIACETYLENE UPON MELT RECRYSTALLIZATION JP LABORATORIES (US) 2026-04-01 EP disclosed
CN-120680094-A High-strength and high-toughness DP540 dual-phase steel gas shielded welding method 包头钢铁(集团)有限责任公司 2025-09-23 CN disclosed
US-4235108-A THERMOCHROMIC ALLIED CHEMICAL CORPORATION (US) 1980-11-25 US disclosed
US-4208501-A PHOTOCONDUCTORS AND OPTICAL DEVICES ALLIED CHEMICAL CORPORATION (US) 1980-06-17 US disclosed
US-4189399-A UNDERGOES COLOR CHANGE WHEN EXPOSED TO ACTINIC RADIATION OR ANNEALING ALLIED CHEMICAL CORPORATION (US) 1980-02-19 US disclosed
US-4164458-A Production of radiation crosslinked polymeric compositions using diacetylenes ALLIED CHEMICAL CORPORATION (US) 1979-08-14 US disclosed
US-3999946-A CONJUGATED ACETYLENE GROUP CONTAINING COMPOUND FOR USE ON PERISHABLE FOODS ALLIED CHEMICAL CORPORATION (US) 1976-12-28 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-12625441-B2 Electrostatic charge image developing toner and image forming method EWSR1, AFF4, DYRK2 GAA 352/4885STAT3 2820/4885ALDH1A1 3383/4885

“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.