SCHEMBL23936707

SCHEMBL23936707

CC1(C)c2ccccc2-c2cccc(-c3nc(-c4ccccc4)c4ccccc4n3)c2C1(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ATM Q13315 1/20 0.46
NUDT1 P36639 3/20 0.44
ADORA2A P29274 4/20 0.41
MAPT P10636 4/20 0.38
GAA P10253 1/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
WHR1 P49842 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
RAD52 P43351 1/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35

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
SCHEMBL23936140 0.93 MEN1 (0.39) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23935949 0.88 KMT2A (0.38) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936408 0.87 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18456033 0.85 MEN1 (0.49) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936737 0.84 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936132 0.84 WHR1 (0.44) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936112 0.83 MEN1 (0.51) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18456113 0.83 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936134 0.83 WHR1 (0.45) MEN1KMT2AATMMAPTGAA
SCHEMBL21868079 0.82 MEN1 (0.44) MEN1KMT2AATMNUDT1ADORA2A

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