SCHEMBL7485891

SCHEMBL7485891

CS(=O)(=O)c1ccccc1-c1oc(C(F)F)cc(=O)c1Oc1ccc(F)cc1F

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.52
PTGS1 P23219 7/20 0.52
BRD4 O60885 2/20 0.36
HSPB1 P04792 1/20 0.35

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
SCHEMBL5100505 0.81 PTGS2 (0.77) PTGS2PTGS1
SCHEMBL1376798 0.80 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7482337 0.79 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL1377386 0.79 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7606499 0.72 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL1379215 0.71 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL1376884 0.68 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL7844081 0.68 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL6580476 0.67 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL5097621 0.67 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263751-A1 2-PHENYLPYRAN-4-ONE DERIVATIVES Almirall Prodesfarma AG (CH) 2002-12-11 EP claimed
WO-2001068633-A1 2-PHENYLPYRAN-4-ONE DERIVATIVES ALMIRALL PRODESFARMA AG (CH) 2001-09-20 WO claimed