SCHEMBL5698570

SCHEMBL5698570

FC(F)(F)c1cn(-c2ccc(S)cc2)c(-c2cccc(Cl)c2)n1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.71
PTGS1 P23219 9/20 0.71

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
SCHEMBL212953 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL213665 0.83 PTGS2 (1.00) PTGS2PTGS1
Sulfamide SCHEMBL4638211 0.82 PTGS2 (0.81) PTGS2PTGS1
SCHEMBL27605211 0.82 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL6265435 0.81 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL7933892 0.79 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL6265221 0.75 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL6264114 0.75 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL13437655 0.73 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL5594597 0.72 PTGS2 (0.81) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682143-A2 COMBINATIONS COMPRISING AN HSP90 INHIBITOR AND A PHOPHODIESTERASE INHIBITOR FOR TREATING OR PREVENTING NEOPLASIA Pharmacia Corporation (US) 2006-07-26 EP disclosed
WO-2005041879-A2 COMBINATIONS COMPRISING AN Hsp90 INHIBITOR AND A PHOPHODIESTERASE INHIBITOR FOR TREATING OR PREVENTING NEOPLASIA PHARMACIA CORPORATION (US) 2005-05-12 WO disclosed