SCHEMBL23936408

SCHEMBL23936408

CC1(C)c2ccccc2-c2c(-c3nc(-c4ccccc4)c4ccccc4n3)cccc2C1(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 0.39
ALDH1A1 P00352 4/20 0.39
RAD52 P43351 1/20 0.39
GAA P10253 1/20 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
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
SCHEMBL23936436 0.93 MEN1 (0.39) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936090 0.91 MEN1 (0.43) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936366 0.91 MEN1 (0.40) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18314282 0.90 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936455 0.88 AURKA (0.38) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936707 0.87 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL21868326 0.86 MEN1 (0.43) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23935966 0.86 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18455557 0.85 MEN1 (0.47) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18455506 0.85 MEN1 (0.45) 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