SCHEMBL25876159

SCHEMBL25876159

CC1(C)c2ccccc2-c2c(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5oc6ccccc6c5c4c3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PGR P06401 1/20 0.31
ALK Q9UM73 2/20 0.30
GAA P10253 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL25875688 0.97 ALK (0.31) ALK
SCHEMBL25876157 0.96 TDP1 (0.30) MEN1MAPTKMT2APGR
SCHEMBL25876011 0.95 ALK (0.32) ALK
SCHEMBL25876304 0.94 HSP90AA1 (0.32)
SCHEMBL25876164 0.94 ALK (0.31) ALK
SCHEMBL25876853 0.94 IDO1 (0.31) IDO1KDM4EALDH1A1HPGDMEN1
SCHEMBL25876165 0.94 ALK (0.33) ALK
SCHEMBL26056664 0.93 CASP3 (0.31)
SCHEMBL25876156 0.92 MAOA (0.32)
SCHEMBL25876010 0.92 ALK (0.30) ALK

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