SCHEMBL24990922

SCHEMBL24990922

c1cc(-c2ccc3ccc4ccc5ccccc5c4c3c2)cc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5ccccc5c34)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PLA2G2A P14555 3/20 0.37
PLA2G4A P47712 3/20 0.37
PLA2G10 O15496 1/20 0.37
ABCG2 Q9UNQ0 3/20 0.36
CYP1A2 P05177 2/20 0.36
AHR P35869 2/20 0.36
PAX8 Q06710 2/20 0.36
CYP1A1 P04798 1/20 0.36
FYN P06241 1/20 0.36
MAPK3 P27361 1/20 0.36
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
HSD17B10 Q99714 4/20 0.35
HPGD P15428 3/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 2/20 0.35
ATM Q13315 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
SCHEMBL24991440 0.98 PLA2G2A (0.38) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990215 0.98 PLA2G2A (0.38) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990552 0.98 TDP1 (0.39) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990504 0.96 TDP1 (0.37) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990869 0.96 TDP1 (0.39) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24930254 0.96 TDP1 (0.42) TDP1L3MBTL1ABCG2CYP1A2AHR
SCHEMBL24990341 0.95 PLA2G2A (0.37) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24991525 0.95 ALDH1A1 (0.39) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990915 0.95 TDP1 (0.40) TDP1L3MBTL1PLA2G2APLA2G4AABCG2
SCHEMBL23759426 0.95 MAPT (0.41) TDP1L3MBTL1PLA2G2APLA2G4APLA2G10

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-2023014190-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-02-09 WO disclosed