SCHEMBL399643

SCHEMBL399643

CS(=O)(=O)c1ccc(-c2ccccc2N)cc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 14/20 0.69
ALDH1A1 P00352 1/20 0.54
HSD17B10 Q99714 1/20 0.54
DRD1 P21728 1/20 0.53
PTGS1 P23219 1/20 0.53
JAK2 O60674 1/20 0.50

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
Hydrochloric Acid SCHEMBL9311376 0.98 PTGS2 (0.67) PTGS2ALDH1A1HSD17B10DRD1PTGS1
SCHEMBL3491279 0.85 PTGS2 (0.59) PTGS2DRD1PTGS1JAK2
SCHEMBL8487915 0.85 PTGS2 (0.75) PTGS2DRD1PTGS1
SCHEMBL1271133 0.84 ALDH1A1 (0.58) PTGS2ALDH1A1HSD17B10PTGS1
SCHEMBL4861820 0.82 CA2 (0.65) PTGS2ALDH1A1HSD17B10DRD1PTGS1
SCHEMBL5502727 0.82 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL18342129 0.81 ALDH1A1 (0.65) PTGS2ALDH1A1HSD17B10PTGS1
SCHEMBL10826584 0.81 ALDH1A1 (0.54) PTGS2ALDH1A1HSD17B10PTGS1
SCHEMBL9311607 0.80 JAK2 (0.53) PTGS2ALDH1A1HSD17B10JAK2
SCHEMBL758098 0.80 CA12 (0.49) PTGS2ALDH1A1HSD17B10PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114340374-B Sowing device and method for treating seeds during planting 先正达参股股份有限公司 2024-06-11 CN disclosed
CN-108463460-B Microbiocidal oxadiazole derivatives 先正达参股股份有限公司 2022-10-28 CN disclosed
CN-109195966-B Microbiocidal thiazole derivatives 先正达参股股份有限公司 2022-09-16 CN disclosed
CN-108430980-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-09-02 CN disclosed
CN-114340374-A Sowing device and method for treating seeds during planting 先正达参股股份有限公司 2022-04-12 CN disclosed
CN-108137517-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-04-12 CN disclosed
CN-114269143-A High precision greenhouse treatment of seeds and seedlings 先正达参股股份有限公司 2022-04-01 CN disclosed
CN-114269144-A Precision processing and sowing or planting method and apparatus 先正达参股股份有限公司 2022-04-01 CN disclosed
CN-114269145-A Apparatus and method for converting an existing sowing apparatus 先正达参股股份有限公司 2022-04-01 CN disclosed
CN-114258261-A Apparatus and method for reducing dust development in precision drilling 先正达参股股份有限公司 2022-03-29 CN disclosed
WO-2010012745-A2 BENZIMIDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-02-04 WO disclosed
US-20090298876-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-12-03 US disclosed
US-20090246820-A1 COMPOUNDS USEFUL IN CFTR ASSAYS AND METHODS THEREWITH VERTEX PHARMACEUTICALS INCORPORATED 2009-10-01 US disclosed
US-20090227797-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-09-10 US disclosed
US-7495103-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-02-24 US disclosed
US-20080071095-A1 Cystic fibrosis transmembrane conductance VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-03-20 US disclosed
US-20060074075-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"), used for treating genetic disorders; respiratory system disorders VERTEX PHARMACEUTICALS INCORPORATED 2006-04-06 US disclosed
EP-0536151-B1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM BOOTS CO PLC (GB) 1994-09-14 EP disclosed
US-5302720-A Biphenyl-substituted guanidine derivatives useful as hypoglycaemic agents THE BOOTS COMPANY (GB) 1994-04-12 US disclosed
WO-1992000273-A1 ORTHOSUBSTITUTED BIPHENYL AMIDINE AND BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM THE BOOTS COMPANY PLC (GB) 1992-01-09 WO 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 (4 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-20090227797-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 PTGS2 1409/4885ALDH1A1 2165/4885HSD17B10 1468/4885
US-20090298876-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 PTGS2 1409/4885ALDH1A1 2165/4885HSD17B10 1468/4885
US-20080071095-A1 Cystic fibrosis transmembrane conductance CFTR, ABCB1, ABCC1 PTGS2 1280/4885ALDH1A1 2651/4885HSD17B10 1678/4885
US-20060074075-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"), used for treating genetic disorders; respiratory system disorders CFTR, ABCC4, ABCC2 PTGS2 1235/4885ALDH1A1 2221/4885HSD17B10 1602/4885

“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.