SCHEMBL7524437

SCHEMBL7524437

O=S1(=O)NCc2cccc3cccc1c23

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.44
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39
GRIA2 P42262 1/20 0.37
SLC40A1 Q9NP59 1/20 0.36
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 5/20 0.36
HPGD P15428 5/20 0.36
KEAP1 Q14145 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
HSD17B10 Q99714 4/20 0.34
CYP1A2 P05177 2/20 0.34
TYMS P04818 1/20 0.34
CYP2C19 P33261 1/20 0.34
BRD4 O60885 1/20 0.34

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
SCHEMBL29681708 0.79 KEAP1 (0.44) GRIA2KDM4EKEAP1CA12CA1
SCHEMBL61176 0.79 KEAP1 (0.44) GRIA2KDM4EKEAP1CA12CA1
Hydrochloric Acid SCHEMBL7399331 0.78 KEAP1 (0.43) GRIA2KDM4EKEAP1CA12CA1
SCHEMBL18638475 0.73 KDM4E (0.46) GRIA2SLC40A1ALDH1A1KDM4EKEAP1
SCHEMBL22097608 0.73 ALDH1A1 (0.39) PARP1CYP3A4TSHRALDH1A1KDM4E
SCHEMBL13513238 0.72 TSHR (0.41) PARP1CYP3A4TSHRALDH1A1KDM4E
SCHEMBL30442903 0.68 CA12 (0.47) CYP3A4TSHRALDH1A1KDM4EHPGD
SCHEMBL812924 0.68 CA12 (0.47) CYP3A4TSHRALDH1A1KDM4EHPGD
SCHEMBL7522934 0.68 CYP3A4 (0.38) PARP1CYP3A4TSHRALDH1A1KDM4E
SCHEMBL255918 0.68 TSHR (0.50) PARP1CYP3A4TSHRALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001290-B1 SUBSTITUTED 2,3-DIHYDROBENZ-(D)-ISOTHIAZOLE-1,1-DIOXIDES AND 2,3-DIHYDRONAPHTHO-(1,8-DE)-1,2-THIAZINE-1,1-DIOXIDES POLAROID CORPORATION (US) 1984-06-27 EP claimed
US-4359574-A Thiazine-1,1-dioxide and isothiazole-1,1-dioxide derivatives POLAROID CORPORATION (US) 1982-11-16 US claimed
US-4311839-A Benzisothiazole and naphtho-1,2-thiazine compounds POLAROID CORPORATION (US) 1982-01-19 US claimed
US-4283537-A Thiazine-1,1-dioxide and isothiazole-1,1-dioxide derivatives and process for preparation POLAROID CORPORATION (US) 1981-08-11 US claimed
US-4259493-A INDICATOR DYES OR PHOTOGRAPHIC LIGHT-SCREENING DYES POLAROID CORPORATION (US) 1981-03-31 US claimed
US-4259498-A Process for preparing benzisothiazole-1,1-dioxide and naphtho-1,2-thiazine-1,1-dioxide compounds POLAROID CORPORATION (US) 1981-03-31 US claimed
US-4255578-A Synthesis of perhalomethylcarbinol-substituted phenol and naphthol sulfamphthalein dyes from the corresponding triacylated derivatives POLAROID CORPORATION (US) 1981-03-10 US claimed
US-4210752-A Synthesis of substituted sulfam(na)phthaleins POLAROID CORPORATION (US) 1980-07-01 US claimed
US-4204061-A Sulfam(na)phthaleins POLAROID CORPORATION (US) 1980-05-20 US claimed
US-4195180-A Sulfam (na) phthaleins POLAROID CORPORATION (US) 1980-03-25 US claimed
US-4191689-A Benzisothiazole-1,1-dioxide and naphtho-1,2-thiazine-1,1-dioxide compounds POLAROID CORPORATION (US) 1980-03-04 US claimed
US-4186001-A IRREVERSIBLE CLEAVAGE IN ALKALINE SOLUTION TO FORM COLORLESS COMPOUND POLAROID CORPORATION (US) 1980-01-29 US claimed
US-4178446-A Sulfam(na)phthaleins POLAROID CORPORATION (US) 1979-12-11 US claimed
US-4178447-A Novel synthesis of 3,3-substituted dihydrobenzisothiazole-1,1-dioxides and -2,3-dihydronaphtho-1,2-thiazine-1,1-dioxides POLAROID CORPORATION (US) 1979-12-11 US claimed
US-4139381-A DIFFUSION TRANSFER, ANTIFOGGING AGENTS POLAROID CORPORATION (US) 1979-02-13 US claimed
EP-1090000-A4 NAPHTHO 1,8-DE]THIASIN-2-YL METHYL CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-11-27 EP disclosed
US-6346526-B1 CARBAPENICILLIN WITH 1,1-DIOXO-2,3-DIHYDRONAPHTHO(1,8-DE)(1,2)THIAZIN-2-YL-SUBSTITUENT; TREATING STAPHYLOCOCCUS INFECTIONS RESISTANT TO METHICILLIN; SIDE EFFECT REDUCTION MERCK & CO., INC. 2002-02-12 US disclosed
EP-0001290-A1 Substituted 2,3-dihydrobenz-(d)-isothiazole-1,1-dioxides and 2,3-dihydronaphtho-(1,8-de)-1,2-thiazine-1,1-dioxides POLAROID CORPORATION (US) 1979-04-04 EP disclosed
EP-0001290-A1 Substituted 2,3-dihydrobenz-(d)-isothiazole-1,1-dioxides and 2,3-dihydronaphtho-(1,8-de)-1,2-thiazine-1,1-dioxides POLAROID CORPORATION (US) 1979-04-04 EP disclosed
US-4139381-A DIFFUSION TRANSFER, ANTIFOGGING AGENTS POLAROID CORPORATION (US) 1979-02-13 US disclosed