SCHEMBL24767017

SCHEMBL24767017

Bc1c(B)c(B)c2c(-c3ccc4oc5ccccc5c4c3)c3c(B)c(B)c(B)c(B)c3c(-c3cccc(-c4cccc5c4-c4ccccc4C5(C)C)c3)c2c1B

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
ALOX5 P09917 1/20 0.33
PLA2G10 O15496 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32
IDO1 P14902 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PGR P06401 1/20 0.31

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
SCHEMBL25005522 0.95 HSP90AA1 (0.35) HSP90AA1HSP90AB1ALOX5IDO1KDM4E
SCHEMBL24822730 0.91
SCHEMBL24479341 0.90 HSP90AA1 (0.34) HSP90AA1HSP90AB1ALOX5PLA2G10PLA2G2A
SCHEMBL21906939 0.90 PLA2G2A (0.34) HSP90AA1HSP90AB1ALOX5PLA2G10PLA2G2A
SCHEMBL24908236 0.88 ALOX5 (0.32) ALOX5KDM4EALDH1A1MAPTHPGD
SCHEMBL24479496 0.84 HSP90AA1 (0.35) HSP90AA1HSP90AB1PLA2G2APLA2G4AKDM4E
SCHEMBL24479807 0.84 HSP90AA1 (0.35) HSP90AA1HSP90AB1PLA2G2APLA2G4AKDM4E
SCHEMBL24767053 0.84 HSP90AA1 (0.35) HSP90AA1HSP90AB1ALOX5IDO1KDM4E
SCHEMBL25052961 0.84 PLA2G2A (0.36) HSP90AA1HSP90AB1ALOX5PLA2G10PLA2G2A
SCHEMBL24767097 0.84

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-20220285625-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2022-09-08 US disclosed