SCHEMBL25503181

SCHEMBL25503181

c1ccc2c(c1)oc1cccc(-c3nc(-c4ccc5c(ccc6oc7ccccc7c65)c4)nc(-c4cccc5sc6ccccc6c45)n3)c12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
S1PR5 Q9H228 3/20 0.31
S1PR4 O95977 2/20 0.31
BACE1 P56817 1/20 0.31
ALOX5 P09917 2/20 0.30
CASP3 P42574 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
HCRTR1 O43613 1/20 0.30
PRKDC P78527 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
SCHEMBL25503549 0.97 BRDT (0.34) BRDTTDP1L3MBTL1
SCHEMBL25503830 0.97 BACE1 (0.33) BRDTTDP1L3MBTL1BACE1CASP3
SCHEMBL25504393 0.97 BRDT (0.32) BRDTTDP1L3MBTL1CASP3SENP7
SCHEMBL25503645 0.96 BRDT (0.34) BRDTTDP1L3MBTL1S1PR5S1PR4
SCHEMBL25503430 0.96 BRDT (0.34) BRDTTDP1L3MBTL1
SCHEMBL25503909 0.96 BRDT (0.32) BRDTTDP1L3MBTL1S1PR5S1PR4
SCHEMBL25504495 0.95 S1PR5 (0.33) BRDTTDP1L3MBTL1S1PR5S1PR4
SCHEMBL25504268 0.94 S1PR5 (0.34) BRDTTDP1L3MBTL1S1PR5S1PR4
SCHEMBL25503745 0.94 BRDT (0.33) BRDTTDP1L3MBTL1S1PR5S1PR4
SCHEMBL25504087 0.94 HCRTR1 (0.33) BRDTTDP1L3MBTL1S1PR5S1PR4

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