SCHEMBL23936452

SCHEMBL23936452

CC1(C)c2cc(-c3ccccc3)ccc2-c2c(-c3nc4ccccc4nc3-c3ccc4c(c3)sc3ccccc34)cccc2C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.33
PI4KA P42356 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
LMNA P02545 3/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 4/20 0.32
TDP1 Q9NUW8 2/20 0.32
F9 P00740 1/20 0.31
CYP1A2 P05177 1/20 0.31
AKT1 P31749 1/20 0.31
AKT2 P31751 1/20 0.31
TDP2 O95551 1/20 0.31
BACE1 P56817 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
SCHEMBL23935996 0.94 F9 (0.34) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL23936281 0.92 ALDH1A1 (0.33) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL23936752 0.90 L3MBTL1 (0.37) PIK3CAPI4KAPI4KBKDM4EALDH1A1
SCHEMBL23936310 0.87 ALDH1A1 (0.35) KDM4EALDH1A1GAAMEN1MAPT
SCHEMBL23936213 0.86 L3MBTL1 (0.33) PIK3CAPI4KAPI4KBKDM4EALDH1A1
SCHEMBL23936110 0.85 KDM4E (0.44) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL23936119 0.85 KDM4E (0.44) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL23936493 0.84 L3MBTL1 (0.37) PIK3CAPI4KAPI4KBKDM4EALDH1A1
SCHEMBL23936430 0.83 L3MBTL1 (0.34) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL23936266 0.81 TDP1 (0.43) KDM4EALDH1A1LMNAGAANPSR1

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed