SCHEMBL25501246

SCHEMBL25501246

c1ccc2c(c1)oc1cccc(-c3nc(-c4ccc5ccc6oc7ccccc7c6c5c4)nc(-c4cccc5sc6ccccc6c45)n3)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 1/20 0.34
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 4/20 0.31
KMT2A Q03164 3/20 0.31
KDM4E B2RXH2 3/20 0.31
MAPT P10636 3/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
BACE1 P56817 1/20 0.31
ALOX5 P09917 2/20 0.31
CHEK2 O96017 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 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
SCHEMBL25501761 0.97 BRDT (0.35) BRDT
SCHEMBL25502918 0.97 BRDT (0.33) BRDTCASP3SENP7SENP6PLA2G10
SCHEMBL25501999 0.97 BACE1 (0.33) BRDTBACE1CASP3SENP7SENP6
SCHEMBL25502261 0.96 BRDT (0.32) BRDTALDH1A1KMT2AKDM4EMAPT
SCHEMBL25501271 0.96 BRDT (0.34) BRDT
SCHEMBL25503038 0.95 BRDT (0.33) BRDTALOX5
SCHEMBL25501778 0.93 BRDT (0.33) BRDTTDP1L3MBTL1ALDH1A1KMT2A
SCHEMBL25502380 0.93 PLA2G2A (0.34) BRDTTDP1L3MBTL1ALDH1A1KMT2A
SCHEMBL25503181 0.92 BRDT (0.34) BRDTTDP1L3MBTL1BACE1ALOX5
SCHEMBL25502561 0.92 ALOX5 (0.35) BRDTALDH1A1KMT2AKDM4EMAPT

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