SCHEMBL24930211

SCHEMBL24930211

c1ccc2c(c1)-c1cccc3c(-c4nc(-c5ccc6c(c5)oc5ccccc56)nc(-c5cccc6oc7ccccc7c56)n4)ccc-2c13

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.38
ALDH1A1 P00352 4/20 0.37
HPGD P15428 4/20 0.37
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
ALOX5 P09917 2/20 0.36
HCRTR1 O43613 1/20 0.36
HSD17B10 Q99714 3/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
HIF1A Q16665 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.35
PRKDC P78527 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CRHBP P24387 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
SCHEMBL25845561 0.93 HCRTR1 (0.37) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL21148608 0.92 AHR (0.44) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL23913891 0.92 AHR (0.44) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL23819357 0.91 L3MBTL1 (0.34) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL23819395 0.91 ALOX5 (0.34) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL23819382 0.90 MAPT (0.35) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL23820781 0.90 AHR (0.38) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL26194754 0.90 ALDH1A1 (0.38) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL25089938 0.89 ALOX5 (0.43) AHRALDH1A1HPGDKDM4EMEN1
SCHEMBL23819490 0.89 HCRTR1 (0.35) AHRALDH1A1HPGDMAPTALOX5

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-2023003146-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-01-26 WO disclosed