SCHEMBL22136622

SCHEMBL22136622

c1ccc(-c2nc(-c3cc(-c4ccc5c(c4)Oc4ccccc4O5)cc(-c4ccc5c(c4)Oc4ccccc4O5)c3)cc(-c3ccc4oc5ccccc5c4c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 5/20 0.40
▸ ADORA1 P30542 5/20 0.40
▸ PLA2G2A P14555 3/20 0.38
▸ PLA2G4A P47712 3/20 0.38
▸ PLA2G10 O15496 1/20 0.38
▸ MEN1 O00255 6/20 0.38
▸ KMT2A Q03164 6/20 0.38
▸ MAPT P10636 5/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ HPGD P15428 5/20 0.38
▸ NTSR1 P30989 1/20 0.38
▸ KDM4E B2RXH2 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ GLA P06280 1/20 0.36
▸ ADORA3 P0DMS8 4/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ CHEK2 O96017 1/20 0.36
▸ NPC1 O15118 2/20 0.36

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
SCHEMBL22136653 0.97 ADORA2A (0.38) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136647 0.94 ADORA2A (0.39) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136547 0.94 MKNK1 (0.37) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136757 0.94 MKNK1 (0.37) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136630 0.91 PLA2G2A (0.40) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL15501982 0.91 MEN1 (0.44) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136662 0.90 PLA2G2A (0.36) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL15501577 0.90 PLA2G2A (0.46) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL15501314 0.90 MAPT (0.45) ADORA2AADORA1PLA2G2APLA2G4APLA2G10
SCHEMBL22136499 0.90 ADORA2A (0.34) ADORA2AADORA1PLA2G2APLA2G4APLA2G10

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-2020130724-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-25 — — WO disclosed
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