SCHEMBL25877252

SCHEMBL25877252

CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4oc5ccc6ccccc6c5c4c3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.33
ALK Q9UM73 1/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PGR P06401 1/20 0.32
PRKDC P78527 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
SCHEMBL25877259 0.97 AHR (0.35) AHRMAPTKMT2AMEN1TP53
SCHEMBL25875797 0.94 KDM4E (0.33) AHRALKMAPTKMT2AMEN1
SCHEMBL15851896 0.94 AHR (0.33) AHRMAPTKMT2AMEN1TP53
SCHEMBL25877006 0.94 KDM4E (0.35) AHRMAPTKMT2AMEN1TP53
SCHEMBL24657954 0.93 TDP1 (0.33) AHRALKMAPTKMT2AMEN1
SCHEMBL25877250 0.93 TDP1 (0.37) AHRALKMAPTKMT2AMEN1
SCHEMBL25876630 0.93 ALK (0.32) ALKMAPTKMT2AMEN1KDM4E
SCHEMBL25875801 0.92 ALK (0.32) AHRALKMAPTKMT2AMEN1
SCHEMBL24372585 0.91 ALDH1A1 (0.34) ALKMAPTKMT2AMEN1KDM4E
SCHEMBL16124240 0.91 NPC1 (0.34) AHRALKMAPTKMT2AMEN1

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