SCHEMBL8397305

SCHEMBL8397305

CS(=O)(=O)c1ccc(-c2coc(=O)n2-c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 1.00
PTGS1 P23219 16/20 1.00

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
SCHEMBL8398364 0.87 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL4577762 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL4575742 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6302878 0.86 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL677082 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5185782 0.86 PTGS2 (0.75) PTGS2PTGS1
SCHEMBL6307729 0.85 PTGS2 (0.80) PTGS2PTGS1
SCHEMBL6300839 0.85 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL5186811 0.84 PTGS2 (0.97) PTGS2PTGS1
SCHEMBL8721601 0.84 PTGS2 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5866596-A DRUGS WITH ANTIINFLAMMATORY AND ANALGESIC PROPERTIES. LABORATORIES UPSA (FR) 1999-02-02 US disclosed