SCHEMBL23936500

SCHEMBL23936500

CC1(C)c2ccccc2-c2c(ccc3cc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)c4ccccc4c23)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.33
WHR1 P49842 1/20 0.32
CYP1A2 P05177 5/20 0.32
CYP3A4 P08684 4/20 0.32
HSD17B10 Q99714 4/20 0.32
CYP2D6 P10635 3/20 0.32
CYP2C19 P33261 3/20 0.32
CLK4 Q9HAZ1 3/20 0.32
CYP2C9 P11712 3/20 0.32
MAPK1 P28482 3/20 0.32
USP2 O75604 2/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 4/20 0.32
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ATM Q13315 2/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL23936015 0.93 MEN1 (0.35) L3MBTL1WHR1HSD17B10MAPK1ALOX15
SCHEMBL23936291 0.91 L3MBTL1 (0.35) L3MBTL1WHR1CYP1A2HSD17B10MAPK1
SCHEMBL23936293 0.86 TERT (0.32) L3MBTL1HSD17B10MAPK1TSHRALDH1A1
SCHEMBL23936030 0.86 HSD17B1 (0.35) L3MBTL1WHR1CYP1A2CYP3A4CYP2D6
SCHEMBL23936128 0.85 L3MBTL1 (0.40) L3MBTL1WHR1ALOX15TSHRALDH1A1
SCHEMBL23936642 0.84 L3MBTL1 (0.35) L3MBTL1WHR1CYP1A2CYP3A4HSD17B10
SCHEMBL23936731 0.82 ALDH1A1 (0.34) L3MBTL1WHR1CYP1A2CYP3A4HSD17B10
SCHEMBL23936411 0.82 L3MBTL1 (0.38) L3MBTL1WHR1HSD17B10ALOX15TSHR
SCHEMBL23936734 0.81 ESR1 (0.37) L3MBTL1WHR1CYP1A2CYP3A4HSD17B10
SCHEMBL23936603 0.81 ALDH1A1 (0.36) L3MBTL1WHR1CYP1A2CYP3A4HSD17B10

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