SCHEMBL29128615

SCHEMBL29128615

CC(C)OCCCSCc1c[nH]c(=S)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ SLC22A4 Q9H015 1/20 0.33

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
SCHEMBL29128428 0.83 — —
SCHEMBL29128359 0.76 ALDH1A1 (0.43) ALDH1A1GAA
SCHEMBL29128318 0.74 DRD2 (0.34) ALDH1A1
SCHEMBL29128222 0.74 HRH3 (0.38) ALDH1A1GAA
SCHEMBL29128451 0.74 — —
SCHEMBL29128300 0.73 LMNA (0.32) —
SCHEMBL29128281 0.72 APP (0.35) —
SCHEMBL29128316 0.72 ALDH1A1 (0.41) ALDH1A1
SCHEMBL29128303 0.69 ALDH1A1 (0.50) ALDH1A1GAA
SCHEMBL29128269 0.68 SLC22A4 (0.35) GAASLC22A4

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-117263862-A Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof 吉首大学 2023-12-22 — — CN disclosed
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