SCHEMBL23819392

SCHEMBL23819392

c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5cc(-c6ccc(-c7ccccc7)c7ccccc67)ccc5c34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
MAPT P10636 6/20 0.36
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
TSHR P16473 2/20 0.36
ATM Q13315 2/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HCRTR1 O43613 1/20 0.36
POLB P06746 1/20 0.36
BACE1 P56817 1/20 0.35
TTR P02766 1/20 0.35

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
SCHEMBL23819383 0.99 MAPT (0.37) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL23819643 0.97 MAPT (0.36) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL25668678 0.95 ALOX5 (0.39) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL24217263 0.95 HCRTR1 (0.40) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL23820605 0.95 HCRTR1 (0.40) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL25019004 0.95 MAPT (0.39) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL25019018 0.95 MAPT (0.39) ALOX5MAPTALDH1A1KDM4EHPGD
SCHEMBL23821481 0.94 MAPT (0.35) MAPTALDH1A1KDM4EHPGDTSHR
SCHEMBL23822195 0.94 MAPT (0.35) MAPTALDH1A1KDM4EHPGDTSHR
SCHEMBL24097369 0.94 ALOX5 (0.40) ALOX5MAPTALDH1A1KDM4EHPGD

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-2021182833-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed