SCHEMBL25845112

SCHEMBL25845112

c1ccc(-c2nc(-c3cc4c5ccccc5ccc4c4ccccc34)nc(-c3cccc4oc5ccc(-c6ccc7ccccc7c6)cc5c34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 5/20 0.39
MAPT P10636 5/20 0.39
HSD17B10 Q99714 4/20 0.39
HPGD P15428 3/20 0.39
TSHR P16473 3/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
KMT2A Q03164 3/20 0.38
MAPK1 P28482 2/20 0.38
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
CYP1A2 P05177 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36

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
SCHEMBL24990545 0.98 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24990491 0.96 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24930758 0.96 MAPT (0.41) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24990509 0.96 MAPT (0.38) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24930415 0.96 MAPT (0.38) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24990505 0.96 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL23820900 0.96 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL24930588 0.95 MAPT (0.40) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL23820961 0.95 MAPT (0.39) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL23821403 0.95 MAPT (0.39) ALDH1A1KDM4EMAPTHSD17B10HPGD

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