SCHEMBL19918569

SCHEMBL19918569

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7oc8cc9c%10c(cccc%10c8c7c6)-c6ccccc6-9)ccc54)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
PTGER4 P35408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
HPSE Q9Y251 2/20 0.31
PLA2G10 O15496 1/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G4A P47712 1/20 0.31
TSPO P30536 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 1/20 0.30

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
SCHEMBL19918567 0.95 HPSE (0.32) PDE10AHPSEPLA2G10PLA2G2APLA2G4A
SCHEMBL19918540 0.95 RAC2 (0.31) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918566 0.95 L3MBTL1 (0.33) L3MBTL1KDM4EATMPTGER4PLA2G10
SCHEMBL19918684 0.94 MEN1 (0.33) L3MBTL1KDM4EATMPTGER4ALDH1A1
SCHEMBL19918434 0.93 ATM (0.36) L3MBTL1KDM4EATMPDE10APLA2G10
SCHEMBL19918436 0.93 ATM (0.36) L3MBTL1KDM4EATMPDE10APLA2G10
SCHEMBL19918573 0.92 PLA2G2A (0.32) L3MBTL1KDM4EATMPLA2G10PLA2G2A
SCHEMBL19918435 0.92 ATM (0.35) L3MBTL1KDM4EATMPDE10AHPSE
SCHEMBL19918534 0.91 TSPO (0.33) L3MBTL1PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918689 0.90

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-2018038400-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME 주식회사 두산 2018-03-01 WO disclosed