SCHEMBL4126964

SCHEMBL4126964

[N-]=[N+]=NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.50
PRSS1 P07477 2/20 0.50
PRSS2 P07478 2/20 0.50
PRSS3 P35030 2/20 0.50
ALDH1A1 P00352 4/20 0.48
CYP3A4 P08684 1/20 0.48
MAPK1 P28482 1/20 0.48
MAPT P10636 2/20 0.47
DUSP3 P51452 1/20 0.46
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA12 O43570 3/20 0.45
CA3 P07451 3/20 0.45
CA4 P22748 3/20 0.45
CA6 P23280 3/20 0.45
CA5A P35218 3/20 0.45
CA7 P43166 3/20 0.45
CA9 Q16790 3/20 0.45
CA13 Q8N1Q1 3/20 0.45
CA14 Q9ULX7 3/20 0.45

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
SCHEMBL10823807 0.89 CA1 (0.43) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL5676376 0.83 CA2 (0.41) F2PRSS1PRSS2PRSS3CA1
SCHEMBL1683277 0.79 F2 (0.50) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL137120 0.79 F2 (0.50) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL580186 0.79 F2 (0.50) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL9645847 0.79 LMNA (0.46) F2PRSS1PRSS2PRSS3CA1
SCHEMBL11596619 0.79 F2 (0.50) F2PRSS1PRSS2PRSS3CA1
SCHEMBL3090434 0.79 F2 (0.52) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL81874 0.78 HTR6 (0.44) ALDH1A1MAPTDUSP3CA1CA2
Hydrochloric Acid SCHEMBL11101814 0.78 F2 (0.50) F2PRSS1PRSS2PRSS3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283678-A Preparation method of C-fluoroalkyl substituted amidine compound and application of C-fluoroalkyl substituted amidine compound in resisting fungal diseases 中国农业大学 2023-06-23 CN claimed
CN-111187184-B Novel method for synthesizing sulfonyl ketoamide 盐城工学院 2022-04-08 CN claimed
CN-111187184-A Novel method for synthesizing sulfonyl ketoamide 盐城工学院 2020-05-22 CN claimed
EP-0606105-B1 Nitro-substituted heterocyclic compounds as insecticides BAYER AGROCHEM KK (JP) 1998-11-25 EP claimed
EP-0606105-A1 Nitro-substituted heterocyclic compounds as insecticides NIHON BAYER AGROCHEM K.K. (JP) 1994-07-13 EP claimed
EP-0398084-A2 Nitro-substituted heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1990-11-22 EP claimed
EP-0296453-A2 Nitrosubstituted heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1988-12-28 EP claimed
CN-119462384-A Pterostilbene derivatives and their use in preparing medicine for treating and/or preventing diseases caused by oxidative stress 常州大学 2025-02-18 CN disclosed
CN-117924125-A Method for preparing sulfonamide derivative through visible light catalysis without metal participation 苏州大学 2024-04-26 CN disclosed
CN-116283678-A Preparation method of C-fluoroalkyl substituted amidine compound and application of C-fluoroalkyl substituted amidine compound in resisting fungal diseases 中国农业大学 2023-06-23 CN disclosed
CN-113549020-B Quinazoline derivatives, their preparation and use 苏州大学 2023-02-10 CN disclosed
CN-109761875-B Novel method for constructing amido bond 盐城工学院 2022-07-19 CN disclosed
CN-110317160-B Novel method for activating sulfonylated 2-phenylisoisatin through C-H 四川大学 2022-07-05 CN disclosed
US-4259494-A ANTIHISTAMINIC, ANTITUSSIVE, ANTIINFLAMMATORY, SEDATIVE, DIURETIC WARNER-LAMBERT COMPANY (US) 1981-03-31 US disclosed
US-4120652-A LOW TEMPERATURE BLEACHING FMC CORPORATION (US) 1978-10-17 US disclosed
US-4110448-A ANTIHISTAMINE, ANTITUSSIVE, ANTIINFLAMMATORY, SEDATIVE, DIURETIC WARNER-LAMBERT COMPANY (US) 1978-08-29 US disclosed
US-4076723-A ANTIHISTAMINES, ANTITUSSIVE AGENTS, ANTIINFLAMMATORY AGENTS, SEDATIVES, DIURETICS WARNER-LAMBERT COMPANY (US) 1978-02-28 US disclosed
US-4033981-A ANTIHISTOMINIC, ANTIINFLAMMATORY, SEDATIVES, DIURETICS WARNER-LAMBERT COMPANY (US) 1977-07-05 US disclosed
US-3992376-A ANTIHISTAMINES, ANTITUSSIVES, SEDATIVES, ANTIINFLAMMATORY AGENTS AND DIURETICS WARNER-LAMBERT COMPANY (US) 1976-11-16 US disclosed
US-3978052-A ANTIHISTAMINIC, ANTITUSSIVE, ANTIINFLAMMATORY, DIURETIC WARNER-LAMBERT COMPANY (US) 1976-08-31 US disclosed