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SCHEMBL22958757

SCHEMBL22958757

c1ccc2c(c1)Oc1cc(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)cc3c1N2c1ccc(-c2ccc(-c4cccc5oc6ccccc6c45)cc2)cc1O3

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.33
▸ PLA2G2A P14555 3/20 0.32
▸ PLA2G4A P47712 3/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 1/20 0.31
▸ PLA2G10 O15496 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
SCHEMBL22958737 0.98 BACE1 (0.34) BACE1PLA2G2APLA2G4AALOX5CASP3
SCHEMBL22958672 0.96 BACE1 (0.34) BACE1PLA2G2APLA2G4AALOX5CASP3
SCHEMBL22958646 0.95 BACE1 (0.35) BACE1PLA2G2APLA2G4AALOX5CASP3
SCHEMBL22958774 0.94 PLA2G2A (0.33) BACE1PLA2G2APLA2G4AALOX5PLA2G10
SCHEMBL22958733 0.94 ALOX5 (0.35) BACE1PLA2G2APLA2G4AALOX5CASP3
SCHEMBL20208646 0.93 ALOX5 (0.34) BACE1ALOX5
SCHEMBL29824930 0.93 ALOX5 (0.34) BACE1ALOX5
SCHEMBL22958732 0.93 PLA2G2A (0.37) BACE1PLA2G2APLA2G4AALOX5CASP3
SCHEMBL22958782 0.93 ALOX5 (0.36) BACE1ALOX5CASP3SENP7SENP6
SCHEMBL22958705 0.93 BACE1 (0.33) BACE1ALOX5

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-20210043852-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-02-11 — — US disclosed