SCHEMBL23935996

SCHEMBL23935996

CC1(C)c2cc(-c3nc4ccccc4nc3-c3ccc4c(c3)sc3ccccc34)ccc2-c2c(-c3ccccc3)cccc2C1(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.34
L3MBTL1 Q9Y468 4/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
ACACA Q13085 2/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
SLC9A1 P19634 2/20 0.32
ALDH1A1 P00352 4/20 0.32
LMNA P02545 4/20 0.32
KDM4E B2RXH2 3/20 0.32
GAA P10253 2/20 0.32
THRB P10828 1/20 0.31
ADORA2A P29274 2/20 0.31
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL23936452 0.94 PIK3CA (0.33) F9L3MBTL1NPSR1MEN1MAPT
SCHEMBL23936281 0.90 ALDH1A1 (0.33) F9L3MBTL1NPSR1MEN1MAPT
SCHEMBL23936310 0.88 ALDH1A1 (0.35) L3MBTL1MEN1MAPTKMT2ATDP1
SCHEMBL23936752 0.87 L3MBTL1 (0.37) L3MBTL1NPSR1MEN1MAPTKMT2A
SCHEMBL23936210 0.86 TDP1 (0.44) L3MBTL1NPSR1MEN1KMT2ATDP1
SCHEMBL23936266 0.85 TDP1 (0.43) L3MBTL1NPSR1MEN1KMT2ATDP1
SCHEMBL23936213 0.84 L3MBTL1 (0.33) L3MBTL1NPSR1MEN1MAPTKMT2A
SCHEMBL23935982 0.83 F9 (0.35) F9L3MBTL1NPSR1MEN1MAPT
SCHEMBL23936402 0.82 ALDH1A1 (0.38) L3MBTL1MAPTKMT2ATDP1AKT1
SCHEMBL23936493 0.81 L3MBTL1 (0.37) L3MBTL1NPSR1MEN1MAPTKMT2A

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