SCHEMBL9568568

SCHEMBL9568568

C[CH]c1ccc(Sc2cc(F)cc(C3(OC)CCOCC3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.43
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL9035603 0.90 ALOX5 (0.45) ALOX5
SCHEMBL9049145 0.87 ALOX5 (0.43) ALOX5PTGS1PTGS2
SCHEMBL9218816 0.86 ALOX5 (0.44) ALOX5PTGS1PTGS2
SCHEMBL9048209 0.86 ALOX5 (0.44) ALOX5PTGS1PTGS2
SCHEMBL9303792 0.84 ALOX5 (0.43) ALOX5PTGS1PTGS2
SCHEMBL9440457 0.84 ALOX5 (0.43) ALOX5PTGS1PTGS2
SCHEMBL9268918 0.84 ALOX5 (0.45) ALOX5PTGS1PTGS2
SCHEMBL9038104 0.83 ALOX5 (0.51) ALOX5PTGS1PTGS2
SCHEMBL9036795 0.83 ALOX5 (0.48) ALOX5PTGS1PTGS2
SCHEMBL9440584 0.83 ALOX5 (0.48) ALOX5PTGS1PTGS2

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-0555067-A1 Hydroxylamine derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP claimed
EP-0555067-A1 Hydroxylamine derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed