SCHEMBL12811629

SCHEMBL12811629

C1=Cc2c(n(-c3ccc4oc5ccc6oc7ccc(-c8ccc9c(c8)c8cc(-c%10ccccc%10)ccc8n9-c8ccccc8)cc7c6c5c4c3)c3ccccc23)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.33
▸ PLA2G4A P47712 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ EDNRB P24530 1/20 0.30
▸ EDNRA P25101 1/20 0.30
▸ PRKDC P78527 2/20 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
SCHEMBL9892634 0.94 PLA2G2A (0.33) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL23739198 0.90 PLA2G2A (0.32) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL23616456 0.89 PLA2G2A (0.34) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL20321594 0.89 KDM4E (0.34) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21599496 0.88 PLA2G2A (0.32) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL9892616 0.88 PLA2G2A (0.35) PLA2G2APLA2G4AATMEDNRBEDNRA
SCHEMBL5028304 0.88 KDM4E (0.31) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL25565129 0.88 KDM4E (0.35) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL13167047 0.88 KDM4E (0.35) PLA2G2APLA2G4AKDM4EATML3MBTL1
SCHEMBL12174836 0.87 SMN1; SMN2 (0.32) KDM4EEDNRBEDNRA

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
EP-2301921-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME Idemitsu Kosan Co., Ltd. (JP) 2011-03-30 — — EP disclosed
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