SCHEMBL23027642

SCHEMBL23027642

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6cccc(-c7ccc8oc9ccccc9c8c7)c6)cc5)cc4)nc(-c4ccccc4-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.44
PLA2G4A P47712 4/20 0.44
PLA2G10 O15496 1/20 0.44
MAPT P10636 5/20 0.39
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
PIM1 P11309 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
CHEK2 O96017 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38

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
SCHEMBL23027697 1.00 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027609 1.00 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027639 1.00 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027650 1.00 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027480 1.00 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027651 0.99 PLA2G2A (0.45) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL21784663 0.97 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL23027567 0.97 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL24318027 0.96 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL21784664 0.96 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10MAPTALDH1A1

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-2021033731-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2021-02-25 WO disclosed