SCHEMBL243972

SCHEMBL243972

CCCS(=O)(=O)NS(=O)(=O)CCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.36
CA2 P00918 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
FAAH O00519 2/20 0.32
PGR P06401 1/20 0.32
NPC1 O15118 1/20 0.31
S1PR2 O95136 1/20 0.31
S1PR4 O95977 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL3021423 0.94 CA1 (0.33) CA1CA2CYP3A4CYP2C9CYP2C19
SCHEMBL15177331 0.89 HPGD (0.41) CA1CA2CA12CA7CA14
SCHEMBL6698147 0.85 CA1 (0.32) CA1CA2CYP3A4CYP2C9CYP2C19
SCHEMBL239451 0.81 HPGD (0.44) CA1CA2CA12CA7CA14
SCHEMBL313150 0.81 CYP3A4 (0.30) CYP3A4CYP2C9CYP2C19
SCHEMBL301013 0.79 FAAH (0.50) CA1CA2CA12CA7CA14
SCHEMBL42331 0.78
SCHEMBL12386316 0.77 EPHX1 (0.44) CA1CA2CYP3A4CYP2C9CYP2C19
SCHEMBL6501307 0.77 FAAH (0.54) CA2FAAHHPGDTSHR
SCHEMBL10226704 0.77 FAAH (0.54) CA2FAAHHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084613-B2 Tetrazoyloxime derivative and plant disease control agent NIPPON SODA CO., LTD. (JP) 2011-12-27 US claimed
CN-111788195-B Protein kinase MKK4 inhibitors for promoting liver regeneration or reducing or preventing hepatocyte death 海帕瑞吉尼克斯股份有限公司 2023-11-21 CN disclosed
US-11414404-B2 Compounds for the treatment of BRAF-associated diseases and disorders ARRAY BIOPHARMA INC. (US) 2022-08-16 US disclosed
EP-3259992-B1 AGROCHEMICAL COMPOSITION NIPPON SODA CO (JP) 2019-01-02 EP disclosed
CN-105473542-B The manufacturing method of optical activity 5- hydroxyl -3- ketone ester class 日产化学工业株式会社 2018-12-04 CN disclosed
EP-2687088-B1 AQUEOUS HORTICULTURAL MICROBICIDAL COMPOSITION SUSPENSION NIPPON SODA CO (JP) 2018-08-01 EP disclosed
US-9926274-B2 Process for producing substituted methylamine compound and triazine derivative NIPPON SODA CO., LTD. (JP) 2018-03-27 US disclosed
US-20180014543-A1 AGROCHEMICAL COMPOSITION NIPPON SODA CO., LTD. (JP) 2018-01-18 US disclosed
EP-3259992-A1 AGROCHEMICAL COMPOSITION Nippon Soda Co., Ltd. (JP) 2017-12-27 EP disclosed
US-9766541-B2 Positive-type resist composition, method for forming resist pattern, photo-reactive quencher, and polymeric compound TOKYO OHKA KOGYO CO., LTD. (JP) 2017-09-19 US disclosed
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-12-24 US disclosed
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-10-15 US disclosed
EP-1947098-A1 CYCLIC AMINE COMPOUNDS AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-07-23 EP disclosed
EP-1932844-A1 BRIDGED CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-06-18 EP disclosed
EP-1658298-B1 PHOSPHORUS-CONTAINING IMIDAZOLINES AND METAL COMPLEXES THEREOF SOLVIAS AG (CH) 2008-03-26 EP disclosed
US-20070010493-A1 Phospinite-imidazolines and metal complexes thereof SOLVIAS AG (CH) 2007-01-11 US disclosed
EP-1658298-A2 NOVEL ORGANIC COMPOUNDS AND METAL COMPLEXES Solvias AG (CH) 2006-05-24 EP disclosed
WO-2005021562-A2 PHOSPINITE-IMIDAZOLINES AND METAL COMPLEXES THEREOF SOLVIAS AG (CH) 2005-03-10 WO disclosed
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 US disclosed
US-6331628-B1 REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-18 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 (6 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-11414404-B2 Compounds for the treatment of BRAF-associated diseases and disorders BRAF, NRAS, RAF1 CA1 4263/4885CA2 3702/4885CYP3A4 1823/4885
US-20070010493-A1 Phospinite-imidazolines and metal complexes thereof H1-0, H1-2, H1-3 CA1 657/4885CA2 364/4885CYP3A4 606/4885
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NPR1, CYCS, CYC1 CA1 1558/4885CA2 1059/4885CYP3A4 1774/4885
US-20180014543-A1 AGROCHEMICAL COMPOSITION CYP4B1, CMA1, CTRL CA1 221/4885CA2 90/4885CYP3A4 208/4885
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 CA1 2761/4885CA2 1990/4885CYP3A4 1368/4885
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control CYCS, NPY1R, CYBB CA1 2058/4885CA2 836/4885CYP3A4 1707/4885

“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.