SCHEMBL25845786

SCHEMBL25845786

c1ccc(-c2ccc3c(c2)oc2cccc(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6c7c(cccc57)-c5ccccc5-6)n4)c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 3/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 2/20 0.34
HCRTR1 O43613 1/20 0.34
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CASP1 P29466 1/20 0.33
HIF1A Q16665 1/20 0.33
PGR P06401 1/20 0.33
CYP1A1 P04798 1/20 0.32

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
SCHEMBL24930313 0.98 ALDH1A1 (0.37) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23819488 0.95 ALDH1A1 (0.36) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23821866 0.94 HCRTR1 (0.37) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23821941 0.94 ALDH1A1 (0.36) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23819396 0.94 ALDH1A1 (0.37) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23821834 0.93 ALDH1A1 (0.39) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23822004 0.93 HCRTR1 (0.37) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23822006 0.93 HCRTR1 (0.37) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL23819357 0.93 L3MBTL1 (0.34) ALDH1A1HSD17B10KDM4ETP53SMN1; SMN2
SCHEMBL25845561 0.92 HCRTR1 (0.37) ALDH1A1HSD17B10KDM4ESMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed