SCHEMBL23936140

SCHEMBL23936140

CC1(C)c2ccccc2-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)c4ccccc4n3)c2C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ATM Q13315 1/20 0.39
NUDT1 P36639 3/20 0.38
ADORA2A P29274 4/20 0.38
RORC P51449 1/20 0.35
WHR1 P49842 1/20 0.34
CYP1A2 P05177 4/20 0.33
NR1I3 Q14994 3/20 0.33
CYP3A4 P08684 3/20 0.33
CYP2C9 P11712 2/20 0.33
VDR P11473 1/20 0.33
CYP2B6 P20813 1/20 0.33
AHR P35869 1/20 0.33
CYP2D6 P10635 3/20 0.33
CYP2C19 P33261 3/20 0.33
CLK4 Q9HAZ1 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL23936707 0.93 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23935949 0.88 KMT2A (0.38) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936436 0.88 MEN1 (0.39) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936442 0.87 MEN1 (0.44) MEN1KMT2AATMADORA2AWHR1
SCHEMBL23936025 0.87 MEN1 (0.47) MEN1KMT2AATMADORA2AWHR1
SCHEMBL23936381 0.85 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL22869040 0.82 MEN1 (0.39) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936408 0.80 MEN1 (0.46) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936737 0.80 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23936132 0.80 WHR1 (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