SCHEMBL25877784

SCHEMBL25877784

CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)oc3ccccc34)c3cc4oc5ccccc5c4c4ccccc34)ccc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
MAPT P10636 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
AHR P35869 2/20 0.33
PGR P06401 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CDC25A P30304 1/20 0.30
CDC25B P30305 1/20 0.30
CDC25C P30307 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
SCHEMBL25878149 0.94 AHR (0.33) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL25877768 0.92 ALK (0.32)
SCHEMBL25516378 0.89 TNKS (0.31)
SCHEMBL21427540 0.89 ALK (0.33) PGR
SCHEMBL22740244 0.88
SCHEMBL25878358 0.88 AHR (0.30) MEN1MAPTKMT2AAHRPGR
SCHEMBL24657387 0.88 TDP1 (0.33) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL22742228 0.87
SCHEMBL24887381 0.87 MEN1 (0.35) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL15851715 0.86 PDK2 (0.32) CDC25ACDC25C

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