SCHEMBL21741833

SCHEMBL21741833

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6ccc(-c7ccc(-c8ccc9c%10c(cccc8%10)-c8ccccc8-9)cc7)cc6c45)n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.39
PLA2G4A P47712 4/20 0.39
PLA2G10 O15496 1/20 0.38
PIM1 P11309 1/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
L3MBTL1 Q9Y468 4/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 4/20 0.34
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ATM Q13315 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL21741699 1.00 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL21741738 0.97 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL21741973 0.96 PLA2G2A (0.37) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL24930303 0.96 PLA2G2A (0.40) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL21741749 0.95 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL19802363 0.95 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL22876474 0.94 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL25844246 0.94 PLA2G2A (0.38) PLA2G2APLA2G4APLA2G10L3MBTL1GAA
SCHEMBL23822193 0.94 PLA2G2A (0.41) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2
SCHEMBL23821484 0.94 PLA2G2A (0.41) PLA2G2APLA2G4APLA2G10PIM1CSNK2A2

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
US-20200058877-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-02-20 US disclosed