SCHEMBL22337115

SCHEMBL22337115

CC1(C)OB(c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccc4ccccc4c2S3)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.40
LIPG Q9Y5X9 3/20 0.40
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
IRAK4 Q9NWZ3 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
SCHEMBL20222391 0.93 LPL (0.38) LPLLIPGMEN1NPC1GAA
SCHEMBL22336961 0.93 LPL (0.41) LPLLIPGMEN1NPC1GAA
SCHEMBL23930773 0.85 LPL (0.39) LPLLIPGPRMT5WDR77IRAK4
SCHEMBL20845223 0.84 LPL (0.37) LPLLIPGMEN1NPC1GAA
SCHEMBL22337087 0.83 LPL (0.44) LPLLIPGPRMT5WDR77IRAK4
SCHEMBL29890510 0.83 LPL (0.41) LPLLIPGPRMT5WDR77IRAK4
SCHEMBL21152215 0.83 LPL (0.41) LPLLIPGPRMT5WDR77IRAK4
SCHEMBL17816656 0.82 LPL (0.40) LPLLIPGPRMT5WDR77IRAK4
SCHEMBL23930725 0.81 LPL (0.41) LPLLIPGPRMT5WDR77
SCHEMBL19797282 0.80 LPL (0.43) LPLLIPGPRMT5WDR77IRAK4

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
WO-2020162703-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-08-13 WO disclosed