SCHEMBL22958666

SCHEMBL22958666

c1ccc(-c2cc3c4c(c2)Oc2cc(-c5cccc6oc7ccccc7c56)ccc2N4c2ccc(-c4ccccc4-c4ccccc4)cc2O3)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.33
PLA2G4A P47712 3/20 0.33
ALOX5 P09917 1/20 0.33
BACE1 P56817 1/20 0.33
PLA2G10 O15496 1/20 0.32
WEE1 P30291 1/20 0.32
PRKDC P78527 3/20 0.31
CDC14B O60729 1/20 0.30
CDC14A Q9UNH5 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
SCHEMBL22958715 0.97 ALOX5 (0.34) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958774 0.94 PLA2G2A (0.33) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958732 0.93 PLA2G2A (0.37) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958733 0.92 ALOX5 (0.35) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958665 0.91 MCL1 (0.33) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958757 0.91 BACE1 (0.33) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958679 0.91 ANO1 (0.33) PLA2G2APLA2G4ABACE1PLA2G10PRKDC
SCHEMBL22958646 0.91 BACE1 (0.35) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958703 0.91 ALOX5 (0.37) PLA2G2APLA2G4AALOX5BACE1PLA2G10
SCHEMBL22958672 0.90 BACE1 (0.34) PLA2G2APLA2G4AALOX5BACE1

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