SCHEMBL23936100

SCHEMBL23936100

CC1(C)c2ccccc2-c2c(-c3nc4ccccc4nc3-c3ccc(-c4ccccc4)cc3)cccc2C1(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 6/20 0.48
LMNA P02545 5/20 0.48
GAA P10253 2/20 0.48
L3MBTL1 Q9Y468 6/20 0.48
TDP1 Q9NUW8 2/20 0.47
NPSR1 Q6W5P4 1/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
AKT1 P31749 1/20 0.42
AKT2 P31751 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
PKM P14618 1/20 0.38
THRB P10828 1/20 0.38
DHODH Q02127 1/20 0.36
PDE10A Q9Y233 1/20 0.36
ATM Q13315 1/20 0.36
TLR9 Q9NR96 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 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
SCHEMBL23936429 0.97 KDM4E (0.50) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936119 0.92 KDM4E (0.44) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936110 0.92 KDM4E (0.44) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936266 0.87 TDP1 (0.43) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23935950 0.86 KDM4E (0.47) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936409 0.86 KDM4E (0.48) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936210 0.85 TDP1 (0.44) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936435 0.85 KMT2A (0.42) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23935990 0.83 KDM4E (0.50) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL23936648 0.82 TDP1 (0.49) KDM4EALDH1A1LMNAGAAL3MBTL1

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