SCHEMBL23936308

SCHEMBL23936308

CC1(C)c2ccccc2-c2cc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)-c4ccccc4C(C)(C)C5(C)C)c3)ccc2C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PDK2 Q15119 13/20 0.35
PGR P06401 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ATM Q13315 2/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
TLR9 Q9NR96 1/20 0.31
APAF1 O14727 1/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL23936055 0.99 PDK2 (0.37) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936245 0.97 PDK2 (0.36) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936516 0.96 PDK2 (0.38) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936510 0.96 PDK2 (0.38) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936495 0.94 PDK2 (0.39) L3MBTL1MAPTPDK2PGRMEN1
SCHEMBL23936529 0.94 PDK2 (0.32) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936489 0.93 PDK2 (0.41) PDK2PGR
SCHEMBL23936722 0.93 PDK2 (0.38) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936783 0.93 PDK2 (0.40) L3MBTL1ALDH1A1MAPTKDM4ECYP1A2
SCHEMBL23936300 0.93 PDK2 (0.40) L3MBTL1MAPTPDK2PGRMEN1

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