SCHEMBL6014083

SCHEMBL6014083

Cc1cccc2sc(S(=O)(=O)NC(C)(C)C)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.52
▸ ALDH1A1 P00352 5/20 0.47
▸ MAPT P10636 7/20 0.45
▸ GAA P10253 1/20 0.42
▸ ACP1 P24666 1/20 0.42
▸ ADORA2A P29274 1/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ MEN1 O00255 7/20 0.40
▸ KMT2A Q03164 7/20 0.40
▸ HTT P42858 2/20 0.40
▸ LMNA P02545 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ HPGD P15428 3/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL28040255 0.83 MEN1 (0.45) PKMALDH1A1MAPTMEN1KMT2A
SCHEMBL27527885 0.78 ALDH1A1 (0.53) PKMALDH1A1MAPTGAAACP1
SCHEMBL29194941 0.77 ALDH1A1 (0.45) PKMALDH1A1MAPTGAAACP1
SCHEMBL29392184 0.77 PSMB8 (0.60) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL32679836 0.77 ALDH1A1 (0.56) PKMALDH1A1MAPTGAAACP1
SCHEMBL721698 0.77 PSMB8 (0.60) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL30903434 0.76 PSMB8 (0.58) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL27658693 0.75 PKM (0.60) PKMALDH1A1MAPTGAAACP1
SCHEMBL29194931 0.74 ALDH1A1 (0.42) PKMALDH1A1MAPTGAAACP1
SCHEMBL14184992 0.72 MAPT (0.56) PKMALDH1A1MAPTGAAACP1

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-20060249417-A1 Scented shoe and shoe packaging system SAUCONY, INC. 2006-11-09 — — US disclosed
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