SCHEMBL29194931

SCHEMBL29194931

CCN(C(C)(C)C)S(=O)(=O)c1nc2c(C)cccc2s1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ PKM P14618 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 7/20 0.39
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ ACP1 P24666 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ACHE P22303 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ PAX8 Q06710 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
SCHEMBL29194941 0.83 ALDH1A1 (0.45) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL2671314 0.80 PSMB8 (0.53) ALDH1A1MAPTLMNAHTTNPSR1
SCHEMBL32679836 0.78 ALDH1A1 (0.56) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL27527885 0.76 ALDH1A1 (0.53) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL6014083 0.74 PKM (0.52) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL27658693 0.70 PKM (0.60) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL1821704 0.68 ALDH1A1 (0.44) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL29194913 0.67 PSMB8 (0.46) ALDH1A1GAAMAPTLMNAHTT
SCHEMBL770398 0.65 MEN1 (0.49) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL799897 0.65 ALDH1A1 (0.58) ALDH1A1PKMGAAMAPTLMNA

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
CN-117715966-A Rubber composition for hose inner pipe, laminate, and hose 株式会社普利司通 2024-03-15 — — CN disclosed
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