SCHEMBL27530295

SCHEMBL27530295

COc1ccc(N=S(=O)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 3/20 0.50
▸ CA7 P43166 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ CA12 O43570 1/20 0.50
▸ CA14 Q9ULX7 1/20 0.50
▸ NOS3 P29474 2/20 0.47
▸ HTR3E A5X5Y0 1/20 0.47
▸ HTR3B O95264 1/20 0.47
▸ HTR3A P46098 1/20 0.47
▸ HTR3D Q70Z44 1/20 0.47
▸ HTR3C Q8WXA8 1/20 0.47
▸ PTGS2 P35354 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ LTA4H P09960 2/20 0.43
▸ ACHE P22303 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ MEN1 O00255 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
Benzene SCHEMBL28711563 0.96 LTA4H (0.50) CA1CA2CA7CA9CA12
SCHEMBL27896820 0.75 HTR3E (0.53) CA1CA2CA7CA9NOS3
SCHEMBL29446760 0.74 ALDH1A1 (0.58) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL156005 0.73 CA1 (0.58) CA1CA2CA7CA9CA12
SCHEMBL1900456 0.72 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL1405603 0.72 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL1405602 0.72 CA1 (0.65) CA1CA2CA7CA9CA12
Ammonia Solution, Strong SCHEMBL28131657 0.71 TDP1 (0.40) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL28031495 0.71 TDP1 (0.40) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL27570550 0.71 TDP1 (0.40) NOS3HTR3EHTR3BHTR3AHTR3D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116239547-A Synthesis method of benzo [ i ] [1,2] thiazine-3, 7, 8-trione-1-oxygen series compound 浙大城市学院 2023-06-09 — — CN disclosed
CN-110143999-A Have cytotoxicity and antimitotic compound and its application method 酵活有限公司 2019-08-20 — — CN disclosed
CN-105358174-B Cytotoxic and antimitotic compounds and methods of use thereof 酵活有限公司 2019-03-15 — — CN disclosed
CN-104507481-B 7-oxo-4, 7-dihydro-pyrazolo [1,5-a ] pyrimidine derivatives for the treatment, amelioration or prevention of a viral disease 萨维拉制药有限公司 2017-08-04 — — CN disclosed
CN-104334563-B 7-oxo-thiazolopyridine carbonic acid derivatives and their use in the treatment, amelioration or prevention of viral diseases 萨维拉制药有限公司 2017-03-08 — — CN disclosed
CN-106459162-A VAR2CSA-drug conjugates 酵活有限公司 2017-02-22 — — CN disclosed
CN-103781813-B The epoxy resin adduct mixed 蓝立方知识产权有限责任公司 2016-09-14 — — CN disclosed
CN-103228694-B Heat curable composition and the thermosetting material prepared by heat curable composition Blue Cube Intellectual Property Co.,Ltd. (US) 2016-04-27 — — CN disclosed
CN-105358174-A Cytotoxic and antimitotic compounds and methods of use thereof CT FOR DRUG RES AND DEV 2016-02-24 — — CN disclosed
CN-104507481-A 7-oxo-4, 7-dihydro-pyrazolo [1,5-a ] pyrimidine derivatives for the treatment, amelioration or prevention of a viral disease SAVIRA PHARMACEUTICALS GMBH 2015-04-08 — — CN disclosed
CN-104334563-A 7-oxo-thiazolopyridine carbonic acid derivatives and their use in the treatment, amelioration or prevention of viral diseases SAVIRA PHARMACEUTICALS GMBH 2015-02-04 — — CN disclosed
CN-1240429-A Preparation and use of ortho-sulfonamido aryl hydroxamic acids as matrix metalloproteinase and TACE inhibitors AMERICAN CYANAMID CO (US) 2000-01-05 — — CN disclosed
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