SCHEMBL23936381

SCHEMBL23936381

CC1(C)c2ccccc2-c2cc(-c3nc(-c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4ccccc4n3)ccc2C1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ATM Q13315 1/20 0.50
WHR1 P49842 1/20 0.41
CYP1A2 P05177 6/20 0.38
CYP3A4 P08684 6/20 0.38
CYP2D6 P10635 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPK1 P28482 3/20 0.38
CYP2C19 P33261 3/20 0.38
HSD17B10 Q99714 3/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 2/20 0.38
NR1I3 Q14994 4/20 0.38
CYP2C9 P11712 3/20 0.38
CYP2B6 P20813 2/20 0.38
AHR P35869 2/20 0.38

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
SCHEMBL23936025 0.98 MEN1 (0.47) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL23936486 0.94 MEN1 (0.49) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL23936331 0.94 MEN1 (0.56) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL23936442 0.91 MEN1 (0.44) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL24647413 0.91 MEN1 (0.52) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL24293823 0.90 MEN1 (0.47) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL24293364 0.89 MEN1 (0.51) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL23936737 0.88 MEN1 (0.50) MEN1KMT2AATMWHR1CYP1A2
SCHEMBL23936492 0.88 MEN1 (0.49) MEN1KMT2AATMWHR1MAPT
SCHEMBL23936112 0.88 MEN1 (0.51) MEN1KMT2AATMWHR1CYP1A2

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