SCHEMBL8559949

SCHEMBL8559949

Cc1cnc(S)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
TSHR P16473 3/20 0.47
CYP3A4 P08684 2/20 0.47
GPR35 Q9HC97 1/20 0.47
KDM4E B2RXH2 2/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
MAPT P10636 3/20 0.40
LMNA P02545 1/20 0.40
PSMD14 O00487 1/20 0.37
COPS5 Q92905 1/20 0.37
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CYP1A2 P05177 2/20 0.37

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
SCHEMBL761929 0.80 SMN1; SMN2 (0.57) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL12161594 0.78 SMN1; SMN2 (0.56) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL131620 0.77 GPR35 (0.57) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL31215172 0.77 GPR35 (0.57) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL30890603 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL126405 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL541340 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL1507262 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL307869 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E
SCHEMBL30230648 0.77 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCYP3A4GPR35KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257397-A1 SYNTHETIC PROCESSES AND SYNTHETIC INTERMEDIATES TAXIS PHARMACEUTICALS, INC. (US) 2023-08-17 US disclosed
EP-3345899-B1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2020-02-19 EP disclosed
EP-3345899-B1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2020-02-19 EP disclosed
EP-3345899-A1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS Allergan, Inc. (US) 2018-07-11 EP disclosed
EP-3345899-A1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS Allergan, Inc. (US) 2018-07-11 EP disclosed
EP-2820010-B1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2018-05-09 EP disclosed
EP-2820010-B1 BENZOFURAN-2-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2018-05-09 EP disclosed
US-20180002347-A1 CONDENSED HETEROCYCLIC COMPOUND HAVING CYCLOALKYLPYRIDYL GROUP OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2018-01-04 US disclosed
US-9416120-B2 Benzofuran-2-sulfonamides pyridine derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2016-08-16 US disclosed
US-9416120-B2 Benzofuran-2-sulfonamides pyridine derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2016-08-16 US disclosed
US-8742112-B2 Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-03 US disclosed
WO-2013130962-A1 BENZOFURAN- 2 - SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-06 WO disclosed
WO-2013130962-A1 BENZOFURAN- 2 - SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-06 WO disclosed
US-20130231339-A1 BENZOFURAN-2-SULFONAMIDES PYRIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-05 US disclosed
US-20130231339-A1 BENZOFURAN-2-SULFONAMIDES PYRIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-05 US disclosed
US-20130231339-A1 BENZOFURAN-2-SULFONAMIDES PYRIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-05 US disclosed
US-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-02 US disclosed
EP-0618209-B1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-12-23 EP disclosed
US-5459138-A Dysfunctions of glutamatergic neurotransmission associated with learning and memory ADIR ET COMPAGNIE (FR) 1995-10-17 US disclosed
EP-0618209-A1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-10-05 EP 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-20130231339-A1 BENZOFURAN-2-SULFONAMIDES PYRIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS CCR2, CXCR2, CXCR4 SMN1; SMN2 3781/4885TSHR 902/4885CYP3A4 1718/4885
US-20230257397-A1 SYNTHETIC PROCESSES AND SYNTHETIC INTERMEDIATES TXN, TBXAS1, TXK SMN1; SMN2 3456/4885TSHR 316/4885CYP3A4 367/4885
US-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST HAAO, DDT, ACHE SMN1; SMN2 1085/4885TSHR 228/4885CYP3A4 138/4885
US-20180002347-A1 CONDENSED HETEROCYCLIC COMPOUND HAVING CYCLOALKYLPYRIDYL GROUP OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE DDT, HCN3, HCN1 SMN1; SMN2 3421/4885TSHR 3062/4885CYP3A4 1311/4885

“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.