SCHEMBL25850427

SCHEMBL25850427

c1ccc2c(-c3ccc(-c4nc(-c5cc6oc7ccccc7c6c6ccccc56)nc(-c5cccc6oc7ccccc7c56)n4)cc3)cccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 5/20 0.39
KDM4E B2RXH2 4/20 0.39
MAPT P10636 4/20 0.39
HPGD P15428 4/20 0.39
ATM Q13315 2/20 0.39
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
RAB9A P51151 2/20 0.37

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
SCHEMBL25850494 0.97 ENPP1 (0.39) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL25508090 0.93 BACE1 (0.39) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL23820656 0.92 ENPP1 (0.43) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL25501431 0.91 ENPP3 (0.39) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL25850894 0.91 HCRTR1 (0.35) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL23821398 0.91 MAPT (0.48) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL25850492 0.90 BACE1 (0.36) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL25850424 0.90 L3MBTL1 (0.38) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL23822808 0.90 PIM1 (0.39) ENPP3ENPP1ALDH1A1HSD17B10KDM4E
SCHEMBL21148479 0.90 ENPP3 (0.39) ENPP3ENPP1ALDH1A1HSD17B10KDM4E

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