SCHEMBL5368809

SCHEMBL5368809

NS(=O)(=O)c1ccc(-c2c(-c3ccc(F)cc3)nn3cc(C(F)(F)F)ccc23)cc1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.69
PTGS2 P35354 11/20 0.55
PTGS1 P23219 6/20 0.55
KIF11 P52732 1/20 0.48
CSNK1A1 P48729 2/20 0.47
CSNK1D P48730 2/20 0.47
CSNK1E P49674 1/20 0.47
CYP2C9 P11712 1/20 0.46
PDPK1 O15530 1/20 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
SCHEMBL5365383 0.91 MAPK14 (0.57) MAPK14PTGS2PTGS1KIF11CYP2C9
SCHEMBL5365336 0.90 MAPK14 (0.56) MAPK14PTGS2PTGS1KIF11CSNK1A1
SCHEMBL5377681 0.89 MAPK14 (0.69) MAPK14PTGS2CSNK1A1CSNK1DCSNK1E
SCHEMBL5366953 0.88 MAPK14 (0.54) MAPK14PTGS2PTGS1KIF11CYP2C9
SCHEMBL5372635 0.84 PTGS2 (0.60) MAPK14PTGS2PTGS1
SCHEMBL6594280 0.84 PTGS1 (0.57) MAPK14PTGS2PTGS1CSNK1A1CSNK1D
SCHEMBL6594699 0.84 MAPK14 (0.68) MAPK14PTGS2PTGS1CSNK1A1CSNK1D
SCHEMBL5365333 0.82 MAPK14 (0.61) MAPK14PTGS2PTGS1CSNK1A1CSNK1D
SCHEMBL5388978 0.82 MAPK14 (1.00) MAPK14KIF11CSNK1A1CSNK1DCSNK1E
SCHEMBL6591441 0.81 MAPK14 (0.70) MAPK14PTGS2PTGS1CSNK1A1CSNK1D

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223772-B1 Pyrazolopyridine derivatives as selective cox-2 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2007-05-29 US claimed
CN-1263755-C Pyrazolopyridine derivatives as selective COX-2 inhibitors GLAXO GROUP LTD (GB) 2006-07-12 CN claimed
EP-1127058-B1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LTD (GB) 2004-09-01 EP claimed
CN-1332741-A Pyrazolopyridine derivatives as selective COX-2 inhibitors GLAZO GROUP LTD (GB) 2002-01-23 CN claimed
EP-1127058-A1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2001-08-29 EP claimed
WO-2000026216-A1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2000-05-11 WO claimed
US-7223772-B1 Pyrazolopyridine derivatives as selective cox-2 inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2007-05-29 US disclosed
CN-1263755-C Pyrazolopyridine derivatives as selective COX-2 inhibitors GLAXO GROUP LTD (GB) 2006-07-12 CN disclosed
EP-1284267-B1 TRIAZOLE COMPOUNDS HAVING AMIDE LINKAGE SANKYO CO (JP) 2004-12-15 EP disclosed
EP-1127058-B1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LTD (GB) 2004-09-01 EP disclosed
US-6653330-B2 Such as 4'-chloro-4-(5-(3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4 -triazol-1-y)butyl)-1,3-dioxan-2-yl)-benzanilide; antifungal activity SANKYO COMPANY, LIMITED (JP) 2003-11-25 US disclosed
US-20030176480-A1 For therapy and prophylaxis of fungal infections SANKYO COMPANY, LIMITED (JP) 2003-09-18 US disclosed
EP-1284267-A1 TRIAZOLE COMPOUNDS HAVING AMIDE LINKAGE Sankyo Company, Limited (JP) 2003-02-19 EP disclosed
CN-1332741-A Pyrazolopyridine derivatives as selective COX-2 inhibitors GLAZO GROUP LTD (GB) 2002-01-23 CN disclosed
EP-1127058-A1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2001-08-29 EP disclosed
WO-2000026216-A1 PYRAZOLOPYRIDINE DERIVATIVES AS SELECTIVE COX-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2000-05-11 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 (1 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-20030176480-A1 For therapy and prophylaxis of fungal infections NAT1, ERG28, DPM1 MAPK14 1351/4885PTGS2 3052/4885PTGS1 801/4885

“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.