SCHEMBL29128226

SCHEMBL29128226

CCc1ccccc1OCSCc1c[nH]c(=O)o1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 7/20 0.39
▸ MAPT P10636 3/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ATM Q13315 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NISCH Q9Y2I1 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ ACHE P22303 1/20 0.33
▸ TSHR P16473 4/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ TP53 P04637 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ LMNA P02545 2/20 0.31
▸ HCAR2 Q8TDS4 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
SCHEMBL29128520 0.87 L3MBTL1 (0.39) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL29128202 0.84 — —
SCHEMBL29128276 0.84 DAO (0.34) MAPTHPGDKDM4EALDH1A1
SCHEMBL29125977 0.79 MAPT (0.38) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL29128211 0.77 — —
SCHEMBL29128237 0.76 L3MBTL1 (0.32) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL29128606 0.76 ADRA1D (0.30) —
SCHEMBL29128408 0.75 L3MBTL1 (0.40) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL29128518 0.75 DAO (0.35) MAPTACHETSHRALDH1A1POLB
SCHEMBL29128164 0.72 APP (0.33) —

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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