SCHEMBL25875693

SCHEMBL25875693

CC1(C)c2ccccc2-c2ccc(N(c3ccc4ccc5oc6ccccc6c5c4c3)c3ccccc3-c3ccccc3)cc21

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.31
ALK Q9UM73 1/20 0.31
ABCG2 Q9UNQ0 2/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
FYN P06241 1/20 0.31
MAPK3 P27361 1/20 0.31
AHR P35869 1/20 0.31
PAX8 Q06710 1/20 0.31

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
SCHEMBL25875862 0.94 PLA2G2A (0.32) PGR
SCHEMBL25875461 0.94 ABCG2 (0.31) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25875793 0.91 ABCG2 (0.30) ALKABCG2
SCHEMBL25875690 0.91 ABCG2 (0.31) PGRABCG2CYP1A1CYP1A2FYN
SCHEMBL16124261 0.91 ALK (0.35) PGRALKAHR
SCHEMBL25875801 0.91 ALK (0.32) ALKAHR
SCHEMBL23512101 0.90
SCHEMBL21019617 0.90 MEN1 (0.33) ALK
SCHEMBL25875691 0.90 PDK2 (0.33) ALK
SCHEMBL25876015 0.89

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