SCHEMBL11294429

SCHEMBL11294429

CC(C)(O)C#Cc1cccc(Oc2ccc(S(=O)(=O)c3ccc(O)cc3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HAO1 Q9UJM8 4/20 0.47
▸ HTT P42858 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ELANE P08246 2/20 0.45
▸ GAA P10253 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CA12 O43570 3/20 0.39
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ ALOX5 P09917 2/20 0.37
▸ FFAR1 O14842 1/20 0.37
▸ LTA4H P09960 1/20 0.36
▸ NR1H2 P55055 1/20 0.36
▸ BAX Q07812 1/20 0.36
▸ FDFT1 P37268 1/20 0.36

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
SCHEMBL11296495 0.95 HTT (0.51) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11293026 0.95 HTT (0.51) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11295179 0.95 HTT (0.51) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11291687 0.94 HAO1 (0.50) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11292550 0.94 HAO1 (0.50) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11292309 0.94 HAO1 (0.50) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11295671 0.93 HAO1 (0.49) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11299857 0.93 HAO1 (0.49) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11292210 0.93 HAO1 (0.49) HAO1HTTTDP1L3MBTL1ELANE
SCHEMBL11296740 0.92 HAO1 (0.48) HAO1HTTTDP1L3MBTL1ELANE

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-4356325-A Process for preparation of acetylene terminated sulfones, oligomers and precursors therefor GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-10-26 — — US disclosed
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