SCHEMBL25501896

SCHEMBL25501896

c1ccc2c(c1)cc(-c1nc(-c3ccc4ccc5oc6ccccc6c5c4c3)nc(-c3cccc4c(-c5cccc6oc7ccccc7c56)cccc34)n1)c1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 4/20 0.38
TSHR P16473 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
CASP1 P29466 2/20 0.38
MAPK1 P28482 2/20 0.38
HIF1A Q16665 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
MAPT P10636 4/20 0.35
KDM4E B2RXH2 3/20 0.35
ALOX15 P16050 1/20 0.35
CASP7 P55210 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
PIM1 P11309 2/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL25501602 0.99 ALDH1A1 (0.38) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501904 0.95 MAOA (0.38) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25653193 0.95 ALDH1A1 (0.40) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501590 0.95 HPGD (0.37) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501895 0.94 L3MBTL1 (0.38) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501599 0.94 MAPT (0.37) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501448 0.93 L3MBTL1 (0.37) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25502085 0.93 ALDH1A1 (0.35) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25501259 0.93 HSD17B10 (0.36) ALDH1A1HPGDHSD17B10TSHRL3MBTL1
SCHEMBL25502068 0.92 ALDH1A1 (0.36) ALDH1A1HPGDHSD17B10TSHRL3MBTL1

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