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SCHEMBL19696340

SCHEMBL19696340

c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)c3c5oc6c(ccc7c6c6ccccc6n7-c6ccccc6)c5ccc3n4-c3ccc(-c4cccc(N(c5ccccc5)c5ccc6c(c5)c5c7oc8c(ccc9c8c8ccccc8n9-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)c7ccc5n6-c5ccc6oc7ccccc7c6c5)c4)cc3)cc2)cc1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ PLA2G2A P14555 1/20 0.30
▸ PLA2G4A P47712 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
SCHEMBL17426335 0.95 PLA2G2A (0.31) PLA2G2APLA2G4A
SCHEMBL17426323 0.94 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL17426296 0.93 PLA2G2A (0.35) TSPOPLA2G2APLA2G4A
SCHEMBL17426287 0.92 PLA2G2A (0.34) KDM4EATML3MBTL1PLA2G2APLA2G4A
SCHEMBL17426316 0.92 MEN1 (0.34) KDM4EATML3MBTL1
SCHEMBL17426269 0.92 PLA2G2A (0.32) KDM4EATML3MBTL1PLA2G2APLA2G4A
SCHEMBL19696341 0.91 PLA2G2A (0.31) PLA2G2APLA2G4A
SCHEMBL17426401 0.91 MEN1 (0.32) KDM4EATML3MBTL1
SCHEMBL17426331 0.91 PLA2G2A (0.36) TSPOKDM4EATML3MBTL1PLA2G2A
SCHEMBL17426390 0.91 MEN1 (0.32) KDM4EATML3MBTL1PLA2G2APLA2G4A

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-9842996-B2 Amine compound having hetero-fused ring and organic electroluminescent element using amine compound IDEMITSU KOSAN CO., LTD. (JP) 2017-12-12 — — US disclosed