SCHEMBL25876629

SCHEMBL25876629

CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(ccc5oc6ccccc6c54)c3)c3ccc4c(c3)oc3ccccc34)cc21

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
AHR P35869 1/20 0.32
PGR P06401 1/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
ALK Q9UM73 1/20 0.31
MAOA P21397 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
SCHEMBL25876630 0.96 ALK (0.32) TDP1L3MBTL1PGRMEN1MAPT
SCHEMBL25877250 0.96 TDP1 (0.37) TDP1L3MBTL1AHRPGRMEN1
SCHEMBL25876560 0.94 PDK2 (0.32) TDP1L3MBTL1ALK
SCHEMBL25876404 0.94 MEN1 (0.34) TDP1L3MBTL1AHRPGRMEN1
SCHEMBL25875796 0.94 TDP1 (0.32) TDP1L3MBTL1AHRPGRMEN1
SCHEMBL25876766 0.93 HCRTR1 (0.33) PGR
SCHEMBL24657968 0.93 TDP1 (0.34) TDP1L3MBTL1AHRPGRMEN1
SCHEMBL26489800 0.92 AHR (0.34) TDP1L3MBTL1AHRMEN1MAPT
SCHEMBL21019620 0.91 ALK (0.33) TDP1AHRPGRMEN1MAPT
SCHEMBL25516371 0.91 ABCG2 (0.31) TDP1L3MBTL1AHRPGR

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
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed