SCHEMBL29128343

SCHEMBL29128343

S=c1[nH]cc(CSCC(I)Oc2cccc(I)c2)o1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ENPP3 O14638 1/20 0.31

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
SCHEMBL29128379 0.86 MAOA (0.31) —
SCHEMBL30799937 0.80 ALDH1A1 (0.38) —
SCHEMBL29128396 0.80 ALDH1A1 (0.38) —
SCHEMBL29128542 0.77 TP53 (0.34) —
SCHEMBL29128169 0.77 ALDH1A1 (0.36) ENPP3
SCHEMBL29128398 0.76 ALDH1A1 (0.38) —
SCHEMBL29128275 0.75 SOD1 (0.33) —
SCHEMBL29128416 0.73 ALDH1A1 (0.33) —
SCHEMBL29128188 0.72 ALDH1A1 (0.32) —
SCHEMBL29128491 0.70 ALDH1A1 (0.37) —

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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