SCHEMBL10929064

SCHEMBL10929064

CC(=O)Nc1ccc(SCC(OS(C)(=O)=O)C(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.48
▸ USP2 O75604 1/20 0.42
▸ GFER P55789 2/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ CA12 O43570 1/20 0.38
▸ RECQL P46063 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
SCHEMBL10927168 0.77 GAA (0.56) GAAUSP2GFERRAB9ANPC1
SCHEMBL9518238 0.70 GAA (0.71) GAAUSP2GFERRAB9ANPC1
SCHEMBL31065560 0.69 GAA (0.60) GAAUSP2GFERRAB9ANPC1
SCHEMBL4051685 0.69 CA1 (0.45) MEN1KMT2AMAPK1ALDH1A1HPGD
SCHEMBL6033907 0.68 GAA (0.69) GAAUSP2RAB9ANPC1MEN1
SCHEMBL4981707 0.66 HPGD (0.48) MEN1KMT2AMAPK1ALDH1A1HPGD
SCHEMBL11002802 0.66 GAA (1.00) GAAUSP2RAB9ANPC1MEN1
SCHEMBL11841835 0.66 GAA (0.65) GAAUSP2GFERRAB9ANPC1
SCHEMBL5962397 0.65 SMN1; SMN2 (0.55) GAARAB9ANPC1MEN1KMT2A
SCHEMBL11010698 0.65 SMN1; SMN2 (0.44) GFERRAB9AMEN1KMT2AMAPK1

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-4518607-A FUNGICIDES, BACXTERICIDES AND ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1985-05-21 — — US disclosed
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