SCHEMBL24361925

SCHEMBL24361925

c1cc(-c2ccc(-n3c4ccccc4c4ccc5ccccc5c43)cc2)cc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cccc4oc5ccccc5c34)n2)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 5/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G4A P47712 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
MTOR P42345 1/20 0.30
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30
TUBA3C P0DPH7 1/20 0.30
TUBA1B P68363 1/20 0.30
TUBA4A P68366 1/20 0.30
TUBB4B P68371 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
SCHEMBL24361930 0.95 SIRT2 (0.33) PDPK1PLA2G2APLA2G4ATDP1L3MBTL1
SCHEMBL24361805 0.95 PDPK1 (0.33) PDPK1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL24361943 0.92 L3MBTL1 (0.34) PDPK1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL24361786 0.92 PLA2G2A (0.34) PLA2G2APLA2G4AL3MBTL1ALDH1A1MAPT
SCHEMBL24361655 0.92 TDP1 (0.32) PDPK1PLA2G2APLA2G4ATDP1L3MBTL1
SCHEMBL24151786 0.92 SIRT2 (0.32) TDP1L3MBTL1ALDH1A1MAPTSIRT2
SCHEMBL26415742 0.92 KDM4E (0.32) TDP1L3MBTL1ALDH1A1MAPTSIRT2
SCHEMBL21862822 0.92 DUSP3 (0.32) PDPK1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL24361804 0.91 L3MBTL1 (0.34) PDPK1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL19271549 0.91 L3MBTL1 (0.34) PDPK1TDP1L3MBTL1ALDH1A1MAPT

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-2022086171-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 WO disclosed