SCHEMBL29128479

SCHEMBL29128479

Fc1cccc(F)c1OCc1c[nH]c(=S)o1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ POLB P06746 2/20 0.38
▸ KMT2A Q03164 6/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ NPC1 O15118 4/20 0.36
▸ RAB9A P51151 4/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL29128219 0.83 ALDH1A1 (0.39) ALDH1A1POLBKMT2AMEN1NPC1
SCHEMBL29128319 0.78 HDAC3 (0.46) ALDH1A1KMT2AMEN1MAPTMAPK1
SCHEMBL30800058 0.78 HDAC3 (0.46) ALDH1A1KMT2AMEN1MAPTMAPK1
SCHEMBL29128414 0.76 SMN1; SMN2 (0.44) ALDH1A1POLBKMT2AMEN1NPC1
SCHEMBL29128286 0.73 KMT2A (0.39) ALDH1A1POLBKMT2AMEN1NPC1
SCHEMBL29128271 0.72 MRGPRX4 (0.40) ALDH1A1KMT2AMEN1L3MBTL1LMNA
SCHEMBL29128523 0.71 LTA4H (0.41) ALDH1A1NPC1RAB9AL3MBTL1LMNA
SCHEMBL30800063 0.71 LTA4H (0.41) ALDH1A1NPC1RAB9AL3MBTL1LMNA
SCHEMBL29128411 0.69 NPC1 (0.52) ALDH1A1POLBKMT2ANPC1RAB9A
SCHEMBL29128331 0.69 NISCH (0.46) ALDH1A1KMT2AMEN1NPC1RAB9A

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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