SCHEMBL25465705

SCHEMBL25465705

c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cncc4oc5c6ccccc6ccc5c34)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.36
ALDH1A1 P00352 7/20 0.36
KDM4E B2RXH2 5/20 0.36
TSHR P16473 5/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 4/20 0.36
MAPK1 P28482 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
ATM Q13315 1/20 0.36
CYP1A1 P04798 5/20 0.35
CYP1A2 P05177 5/20 0.35
CYP1B1 Q16678 5/20 0.35
KMT2A Q03164 3/20 0.35
PRKDC P78527 2/20 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
SCHEMBL25465900 0.96 MAPT (0.35) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25508595 0.92 MAPT (0.37) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25465079 0.92 MAPT (0.41) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25847063 0.92 MAPT (0.42) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25508723 0.92 CYP1A1 (0.35) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25465280 0.90 MAPT (0.40) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25465091 0.90 CYP1A1 (0.37) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL23946966 0.90 MAPT (0.39) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL24193128 0.90 MAPT (0.40) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL23946752 0.89 MAPT (0.36) MAPTALDH1A1KDM4ETSHRHSD17B10

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-2023085834-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-05-19 WO disclosed