SCHEMBL25876404

SCHEMBL25876404

CC1(C)c2ccccc2-c2cc(N(c3ccc4c(ccc5oc6ccccc6c54)c3)c3ccc4c(c3)oc3ccccc34)ccc21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
AHR P35869 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PGR P06401 1/20 0.32

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
SCHEMBL25876405 0.96 KDM4E (0.35) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL25875469 0.94 MEN1 (0.34) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL25876395 0.94 TDP1 (0.32) TDP1L3MBTL1
SCHEMBL25876629 0.94 TDP1 (0.32) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL25876554 0.93 HCRTR1 (0.33) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL24656918 0.93 TDP1 (0.34) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL26851320 0.92 TDP1 (0.31) TDP1L3MBTL1
SCHEMBL25516374 0.91 ABCG2 (0.31) TDP1L3MBTL1AHR
SCHEMBL26060281 0.90 MEN1 (0.35) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL24656925 0.90 KDM4E (0.33) MEN1MAPTKMT2AKDM4EALDH1A1

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