SCHEMBL11186397

SCHEMBL11186397

CS(=O)(=O)Nc1cc2c(cc1Oc1ccc(Cl)cc1)C(=O)CC2

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.76
PTGS1 P23219 5/20 0.56

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
SCHEMBL11182826 0.88 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL8623711 0.88 PTGS2 (0.75) PTGS2PTGS1
SCHEMBL11181115 0.87 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL3247329 0.86 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL11176934 0.83 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL11182596 0.83 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL11177588 0.78 PTGS2 (0.81) PTGS2PTGS1
Flosulide SCHEMBL195509 0.77 PTGS2 (1.00) PTGS2PTGS1
Flosulide SCHEMBL29383035 0.77 PTGS2 (1.00) PTGS2PTGS1
Flosulide SCHEMBL29454969 0.77 PTGS2 (1.00) 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
EP-0009554-B1 INDANYL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1983-04-27 EP claimed
US-4244960-A HERBICIDES OR ANTIINFLAMMATORY AGENTS SCHERING, AKTIENGESELLSCHAFT (DE) 1981-01-13 US claimed
EP-0009554-A1 Indanyl derivatives, process for their preparation and pharmaceutical compositions containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1980-04-16 EP claimed
EP-0009554-B1 INDANYL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1983-04-27 EP disclosed
US-4244960-A HERBICIDES OR ANTIINFLAMMATORY AGENTS SCHERING, AKTIENGESELLSCHAFT (DE) 1981-01-13 US disclosed
EP-0009554-A1 Indanyl derivatives, process for their preparation and pharmaceutical compositions containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1980-04-16 EP disclosed