SCHEMBL4457937

SCHEMBL4457937

Cc1cccc(S(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.48
PARP1 P09874 1/20 0.42
LMNA P02545 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KCNK3 O14649 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL30891540 1.00 ACHE (0.48) ACHEPARP1LMNAHDAC8HDAC6
SCHEMBL7520839 0.98 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6
SCHEMBL7521244 0.98 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6
SCHEMBL7139905 0.98 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6
SCHEMBL1585001 0.98 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6
SCHEMBL10775693 0.83 HPGD (0.32) LMNAHSD17B10ALDH1A1KCNH2
SCHEMBL29169693 0.82 CYP1A2 (0.36) ACHEHSD17B10ALDH1A1GAAMEN1
Toluene SCHEMBL28106985 0.79 LMNA (0.52) ACHELMNAALDH1A1TSHRSMN1; SMN2
SCHEMBL1584999 0.76 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6
Lithium Ion SCHEMBL7521237 0.76 ACHE (0.46) ACHEPARP1LMNAHDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117142916-B Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2024-10-11 CN claimed
CN-117142916-A Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2023-12-01 CN claimed
CN-110627693-B Allyl sulfone compound and preparation method and application thereof 南京工业大学 2021-06-04 CN claimed
CN-110627693-A Allyl sulfone compound and preparation method and application thereof 南京工业大学 2019-12-31 CN claimed
CN-117142916-B Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2024-10-11 CN disclosed
CN-117142916-A Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2023-12-01 CN disclosed
US-11802110-B2 2-amino-N-(arylsulfinyl)-acetamide compounds as inhibitors of bacterial aminoacyl-tRNA synthetase Oxford Drug Design Limited (GB) 2023-10-31 US disclosed
CN-110627693-B Allyl sulfone compound and preparation method and application thereof 南京工业大学 2021-06-04 CN disclosed
WO-2021047674-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR 南京明德新药研发有限公司 2021-03-18 WO disclosed
EP-2478981-B1 SILVER-(CONJUGATED COMPOUND) COMPLEX SUMITOMO CHEMICAL CO (JP) 2020-12-23 EP disclosed
CN-111743782-A Powder-liquid type dental resin reinforced glass ionomer cement composition 株式会社松风 2020-10-09 CN disclosed
CN-111743783-A Double-paste type dental resin reinforced glass ion cement composition 株式会社松风 2020-10-09 CN disclosed
US-7041714-B2 Dental adhesive TOKUYAMA CORPORATION (JP) 2006-05-09 US disclosed
EP-1524289-A1 POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2005-04-20 EP disclosed
US-20040254258-A1 Polymerizable composition, optical material comprising the composition and method for producing the material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2004-12-16 US disclosed
EP-1459726-A1 ADHESIVES FOR DENTAL USE TOKUYAMA CORPORATION (JP) 2004-09-22 EP disclosed
US-20040077746-A1 Adhesives for dental use TOKUYAMA CORPORATION (JP) 2004-04-22 US disclosed
US-5145611-A Diabetes BOEHRINGER MANNHEIM GMBH (DE) 1992-09-08 US disclosed
US-4764203-A Herbicidal sulfonylureas CIBA-GEIGY CORPORATION (US) 1988-08-16 US disclosed
US-4602084-A Monoazo dyes containing a 4-substituted-2-azo-1,1'-diphenylsulfone component CIBA-GEIGY CORPORATION (US) 1986-07-22 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 (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-20040077746-A1 Adhesives for dental use ICAM1, CDH1, VCAM1 ACHE 737/4885PARP1 2727/4885LMNA 3337/4885
US-11802110-B2 2-amino-N-(arylsulfinyl)-acetamide compounds as inhibitors of bacterial aminoacyl-tRNA synthetase AARS1, NSUN3, GARS1 ACHE 4392/4885PARP1 2614/4885LMNA 2218/4885

“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.