SCHEMBL3213024

SCHEMBL3213024

CCCCOC(=O)C[S+](CC(=O)OCCCC)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.51
L3MBTL1 Q9Y468 5/20 0.51
TDP1 Q9NUW8 3/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 5/20 0.47
MAPK1 P28482 3/20 0.47
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.46
HSD17B10 Q99714 2/20 0.45
LMNA P02545 3/20 0.45
POLB P06746 1/20 0.43
ALOX15 P16050 1/20 0.43
LTA4H P09960 1/20 0.42
GAA P10253 2/20 0.41
ESR1 P03372 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
NR1H2 P55055 1/20 0.41

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
SCHEMBL3201098 0.87 TSHR (0.51) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL456516 0.75 ALDH1A1 (0.59) TSHRL3MBTL1TDP1MEN1KMT2A
Toluene SCHEMBL9711835 0.73 NAAA (0.56) TSHRL3MBTL1TDP1MEN1KMT2A
Hydrochloric Acid SCHEMBL27576461 0.73 L3MBTL1 (0.58) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL27672935 0.73 ALDH1A1 (0.58) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL23191566 0.72 TSHR (0.53) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL7647369 0.72 LTA4H (0.61) TSHRL3MBTL1TDP1ALDH1A1TP53
SCHEMBL11655422 0.72 LTA4H (0.61) TSHRLTA4H
SCHEMBL648865 0.72 TSHR (0.53) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL10007438 0.72 TDP1 (0.77) TSHRL3MBTL1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118459372-A Preparation method of photoacid generator sulfonate for ARF photoresist 常州朗芯新材料科技有限公司 2024-08-09 CN disclosed
US-20180011401-A1 SULFONIC ACID DERIVATIVE, PHOTOACID GENERATOR USING SAME, RESIST COMPOSITION, AND DEVICE MANUFACTURING METHOD TOYO GOSEI CO., LTD. (JP) 2018-01-11 US disclosed
US-9714217-B2 Sulfonic acid derivative and photoacid generator TOYO GOSEI CO., LTD. (JP) 2017-07-25 US disclosed
US-20130130175-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method CENTRAL GLASS COMPANY, LIMITED (JP) 2013-05-23 US disclosed
US-8435717-B2 Compound for photoacid generator, resist composition using the same, and pattern-forming method CENTRAL GLASS COMPANY, LIMITED (JP) 2013-05-07 US disclosed
US-20120289738-A1 SULFONIC ACID DERIVATIVE AND PHOTOACID GENERATOR TOYO GOSEI CO., LTD. (JP) 2012-11-15 US disclosed
US-20100035185-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method CENTRAL GLASS COMPANY, LTD. (JP) 2010-02-11 US disclosed
US-7414148-B2 Process for producing alkoxycarbonylfluoroalkanesulfonates CENTRAL GLASS COMPANY LIMITED (JP) 2008-08-19 US disclosed
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES CENTRAL GLASS COMPANY, LIMITED (JP) 2008-05-08 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 (5 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-20180011401-A1 SULFONIC ACID DERIVATIVE, PHOTOACID GENERATOR USING SAME, RESIST COMPOSITION, AND DEVICE MANUFACTURING METHOD ASIC1, ASIC3, CRY1 TSHR 2626/4885L3MBTL1 4346/4885TDP1 4756/4885
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES ARSA, PFAS, MPST TSHR 3426/4885L3MBTL1 4866/4885TDP1 4653/4885
US-20100035185-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method ASIC1, RER1, INSRR TSHR 1202/4885L3MBTL1 4479/4885TDP1 2802/4885
US-20120289738-A1 SULFONIC ACID DERIVATIVE AND PHOTOACID GENERATOR CRY1, ASIC1, ASIC3 TSHR 1768/4885L3MBTL1 3903/4885TDP1 4851/4885
US-20130130175-A1 Compound for Photoacid Generator, Resist Composition Using the Same, and Pattern-Forming Method ASIC1, RER1, INSRR TSHR 988/4885L3MBTL1 4435/4885TDP1 2704/4885

“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.