SCHEMBL29128308

SCHEMBL29128308

CCNc1cccc(OCSCc2c[nH]c(=S)[nH]2)c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ F10 P00742 1/20 0.30

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
SCHEMBL30799867 1.00 ALDH1A1 (0.32) ALDH1A1HPGDMAPTF10
SCHEMBL29128277 0.86 LMNA (0.38) ALDH1A1MAPT
SCHEMBL30800008 0.86 LMNA (0.38) ALDH1A1MAPT
SCHEMBL29128262 0.82 ALDH1A1 (0.42) ALDH1A1HPGDMAPT
SCHEMBL30800003 0.82 ALDH1A1 (0.42) ALDH1A1HPGDMAPT
SCHEMBL29128312 0.76 ALDH1A1 (0.37) ALDH1A1HPGDMAPT
SCHEMBL30799842 0.76 ALDH1A1 (0.37) ALDH1A1HPGDMAPT
SCHEMBL29128350 0.74 SOD1 (0.36) ALDH1A1HPGDMAPT
SCHEMBL30799897 0.73 KDM4E (0.33) ALDH1A1HPGD
SCHEMBL29128544 0.73 KDM4E (0.33) ALDH1A1HPGD

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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