SCHEMBL6289796

SCHEMBL6289796

Cc1ccc(-n2c(-c3ccc(S(C)(=O)=O)cc3)cnc2Cl)cc1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.79
PTGS1 P23219 5/20 0.63

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
SCHEMBL6289831 0.88 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6290668 0.88 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL6290551 0.78 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL6293890 0.76 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL7212097 0.76 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL14533641 0.73 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL6289849 0.72 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL8310335 0.72 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL6289850 0.72 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8800251 0.72 PTGS2 (0.74) 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