SCHEMBL6291189

SCHEMBL6291189

NS(=O)(=O)c1ccc(-n2cnc(Cl)c2-c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.75
PTGS1 P23219 11/20 0.75

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
SCHEMBL6291225 0.87 PTGS2 (0.82) PTGS2PTGS1
SCHEMBL6776307 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6773532 0.84 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6776031 0.84 PTGS2 (0.80) PTGS2PTGS1
SCHEMBL6179878 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6293771 0.83 PTGS2 (1.00) PTGS2PTGS1
Hydrochloric Acid SCHEMBL6773051 0.83 PTGS2 (0.79) PTGS2PTGS1
SCHEMBL6291037 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6291217 0.82 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6178205 0.80 PTGS2 (0.72) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6838476-B1 Cyclooxygenase inhibitors; anticancer agents J. URIACH & CIA, SA (ES) 2005-01-04 US claimed
EP-1122243-B1 NOVEL IMIDAZOLES WITH ANTI-INFLAMMATORY ACTIVITY URIACH Y COMPANIA S A J (ES) 2004-09-08 EP claimed
EP-1122243-A1 NOVEL IMIDAZOLES WITH ANTI-INFLAMMATORY ACTIVITY J. URIACH & CIA. S.A. (ES) 2001-08-08 EP claimed
US-6838476-B1 Cyclooxygenase inhibitors; anticancer agents J. URIACH & CIA, SA (ES) 2005-01-04 US disclosed
EP-1122243-B1 NOVEL IMIDAZOLES WITH ANTI-INFLAMMATORY ACTIVITY URIACH Y COMPANIA S A J (ES) 2004-09-08 EP disclosed
EP-1122243-A1 NOVEL IMIDAZOLES WITH ANTI-INFLAMMATORY ACTIVITY J. URIACH & CIA. S.A. (ES) 2001-08-08 EP disclosed