SCHEMBL2800192

SCHEMBL2800192

O=Cc1ccc(S(=O)(=O)O)cc1.[NaH]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.61
▸ LMNA P02545 1/20 0.52
▸ ALDH1A1 P00352 6/20 0.50
▸ TSHR P16473 2/20 0.50
▸ NT5E P21589 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ ALDH5A1 P51649 1/20 0.48
▸ ABAT P80404 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.43
▸ CYP2A6 P11509 3/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ STS P08842 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MMP1 P03956 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP13 P45452 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
SCHEMBL226161 0.98 TDP1 (0.64) TDP1LMNAALDH1A1TSHRNT5E
Hydrochloric Acid SCHEMBL28303489 0.95 TDP1 (0.61) TDP1LMNAALDH1A1TSHRNT5E
Water SCHEMBL2368741 0.95 TDP1 (0.61) TDP1LMNAALDH1A1TSHRNT5E
SCHEMBL2944205 0.91 TDP1 (0.57) TDP1LMNAALDH1A1TSHRNT5E
SCHEMBL12212935 0.91 TDP1 (0.57) TDP1LMNAALDH1A1TSHRNT5E
SCHEMBL11337452 0.89 TDP1 (0.55) TDP1LMNAALDH1A1TSHRNT5E
Benzaldehyde SCHEMBL28682150 0.85 TSHR (0.67) TDP1LMNAALDH1A1TSHRNT5E
Benzaldehyde SCHEMBL29098206 0.82 TSHR (0.70) TDP1LMNAALDH1A1TSHRNT5E
SCHEMBL545629 0.82 LMNA (0.72) TDP1LMNAALDH1A1TSHRNT5E
SCHEMBL20421629 0.82 LMNA (0.72) TDP1LMNAALDH1A1TSHRNT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924219-A Vegetable gum stabilizer for oil field and preparation method thereof 山东滨州昱诚化工科技有限公司 2024-04-26 — — CN claimed
EP-2460855-A2 Oxygen scavenging compositions and packaging comprising said compositions Constar International Inc. (US) 2012-06-06 — — EP claimed
US-20090278087-A1 Oxygen Scavenging Compositions and Packaging Comprising Said Compositions CONSTAR INTERNATIONAL, INC (US) 2009-11-12 — — US claimed
CN-101193976-A Oxygen scavenging compositions and packages comprising the same CONSTAR INT INC (US) 2008-06-04 — — CN claimed
EP-1848659-A2 OXYGEN SCAVENGING COMPOSITIONS AND PACKAGING COMPRISING SAID COMPOSITIONS Constar International Inc. (US) 2007-10-31 — — EP claimed
WO-2006088889-A2 OXYGEN SCAVENGING COMPOSITIONS AND PACKAGING COMPRISING SAID COMPOSITIONS CONSTAR INTERNATIONAL, INC. (US) 2006-08-24 — — WO claimed
US-20060180790-A1 polyesters; melt polymerization; packaging CONSTAR INTERNATIONAL INC. (US) 2006-08-17 — — US claimed
CN-117924219-A Vegetable gum stabilizer for oil field and preparation method thereof 山东滨州昱诚化工科技有限公司 2024-04-26 — — CN disclosed
CN-113651733-A Synthesis process and continuous separation process of sodium o-sulfonate benzaldehyde 赤峰市恒荣化工有限公司 2021-11-16 — — CN disclosed
CN-106968111-B Preparation method of air bag of air pressure type automobile massage seat 上海翊山电器有限公司 2020-07-28 — — CN disclosed
US-8721920-B2 Oxygen scavenging compositions and packaging comprising said compositions PLASTIPAK PACKAGING, INC. (US) 2014-05-13 — — US disclosed
CN-102199337-B Packaging wall, method for preparing products, method of packaging oxygen sensitive material and method for preparing packaging material CONSTAR INTERNAT LLC 2014-01-29 — — CN disclosed
EP-1848659-B1 OXYGEN SCAVENGING COMPOSITIONS AND PACKAGING COMPRISING SAID COMPOSITIONS CONSTAR INT INC (US) 2013-03-20 — — EP disclosed
US-20060180790-A1 polyesters; melt polymerization; packaging CONSTAR INTERNATIONAL INC. (US) 2006-08-17 — — US disclosed
US-20050182060-A1 2-Substituted and 4-substituted aryl nitrone compounds RENOVIS, INC. 2005-08-18 — — US disclosed
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 — — US disclosed
US-5302417-A Aqueous dispersion and substrate coated with the same KURARAV CO., LTD. (JP) 1994-04-12 — — US disclosed
US-5272200-A Aqueous dispersion and substrate coated with the same KURARAY CO., LTD. (JP) 1993-12-21 — — US disclosed
EP-0525205-A1 AQUEOUS DISPERSION AND BASE MATERIAL COATED THEREWITH KURARAY CO., LTD. (JP) 1993-02-03 — — EP disclosed
US-4757135-A Copper-containing fiber reactive dye HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-12 — — 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 (3 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-20090278087-A1 Oxygen Scavenging Compositions and Packaging Comprising Said Compositions LPO, GPX4, PRDX3 TDP1 1743/4885LMNA 315/4885ALDH1A1 548/4885
US-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 TDP1 3063/4885LMNA 4522/4885ALDH1A1 1488/4885
US-20050182060-A1 2-Substituted and 4-substituted aryl nitrone compounds CXCR2, CCL5, CCL2 TDP1 3308/4885LMNA 3216/4885ALDH1A1 226/4885

“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.

Send feedback