SCHEMBL21916439

SCHEMBL21916439

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c3cc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PTGER4 P35408 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ TSPO P30536 1/20 0.31
▸ HDAC4 P56524 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
SCHEMBL18518165 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518994 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL14822631 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518833 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518227 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518999 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518075 0.98 KDM4E (0.40) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518995 0.96 KDM4E (0.37) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18519180 0.96 KDM4E (0.37) KDM4EATML3MBTL1PTGER4PGR
SCHEMBL18518701 0.96 KDM4E (0.38) KDM4EATML3MBTL1PTGER4PGR

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-3335254-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-04-08 — — EP disclosed
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