SCHEMBL25501993

SCHEMBL25501993

c1ccc2c(-c3cccc4oc5ccccc5c34)cc(-c3nc(-c4ccc5ccc6oc7ccccc7c6c5c4)nc(-c4cccc5sc6ccccc6c45)n3)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 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
SCHEMBL25501778 0.95 BRDT (0.33) BRDTMEN1ALDH1A1MAPTHPGD
SCHEMBL25503745 0.95 BRDT (0.33) BRDT
SCHEMBL25501246 0.92 BRDT (0.34) BRDTMEN1ALDH1A1MAPTHPGD
SCHEMBL25503645 0.91 BRDT (0.34) BRDT
SCHEMBL25501761 0.91 BRDT (0.35) BRDT
SCHEMBL25501992 0.91 ALDH1A1 (0.35) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL23820480 0.90 ALDH1A1 (0.34) BRDTALDH1A1MAPTHPGDHSD17B10
SCHEMBL24656328 0.90 MAPT (0.35) BRDTALDH1A1MAPTHPGDKMT2A
SCHEMBL25501271 0.90 BRDT (0.34) BRDT
SCHEMBL25501999 0.89 BACE1 (0.33) BRDT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed
WO-2023096318-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-06-01 WO disclosed