SCHEMBL23936135

SCHEMBL23936135

CC1(C)c2ccccc2-c2cccc(-c3ccc4nc(-c5ccccc5)c(-c5ccccc5)nc4c3)c2C1(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 7/20 0.48
L3MBTL1 Q9Y468 5/20 0.48
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
TLR9 Q9NR96 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
GAA P10253 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 6/20 0.41
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 2/20 0.40
PIK3R1 P27986 4/20 0.39
PIK3CA P42336 4/20 0.39
AKT1 P31749 1/20 0.38
AKT2 P31751 1/20 0.38
MAPT P10636 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
SCHEMBL23935950 0.88 KDM4E (0.47) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936409 0.88 KDM4E (0.48) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23935990 0.87 KDM4E (0.50) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936219 0.86 ALDH1A1 (0.50) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936473 0.86 ALDH1A1 (0.50) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936736 0.85 TDP1 (0.45) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936468 0.84 TDP1 (0.44) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936469 0.82 KMT2A (0.43) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936113 0.82 TDP1 (0.50) KDM4EALDH1A1L3MBTL1KMT2AATM
SCHEMBL23936382 0.82 TDP1 (0.50) KDM4EALDH1A1L3MBTL1KMT2AATM

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