SCHEMBL23936752

SCHEMBL23936752

CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(-c3nc4ccccc4nc3-c3ccc4c(c3)sc3ccccc34)cc2C1(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
PIK3CA P42336 2/20 0.36
AKT1 P31749 1/20 0.36
AKT2 P31751 1/20 0.36
PI4KA P42356 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
TDP2 O95551 1/20 0.35
LMNA P02545 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
THRB P10828 1/20 0.34
BACE1 P56817 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 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
SCHEMBL23936213 0.94 L3MBTL1 (0.33) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL23936310 0.92 ALDH1A1 (0.35) L3MBTL1TDP1AKT1AKT2ALDH1A1
SCHEMBL23936493 0.91 L3MBTL1 (0.37) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL23936452 0.90 PIK3CA (0.33) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL23935996 0.87 F9 (0.34) L3MBTL1TDP1AKT1AKT2ALDH1A1
SCHEMBL23936402 0.85 ALDH1A1 (0.38) L3MBTL1TDP1AKT1AKT2ALDH1A1
SCHEMBL23936145 0.84 TDP1 (0.51) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL23936748 0.84 TDP1 (0.51) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL24266810 0.83 L3MBTL1 (0.44) L3MBTL1TDP1PIK3CAAKT1AKT2
SCHEMBL15040965 0.81 ALDH1A1 (0.49) L3MBTL1TDP1AKT1AKT2ALDH1A1

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