SCHEMBL18518229

SCHEMBL18518229

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5cccc6c5c5ccccc5n6-c5ccccc5)cc(-n5c6ccccc6c6ccccc65)c4)c3cc21

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PGR P06401 2/20 0.31
▸ HDAC4 P56524 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
SCHEMBL18518816 0.91 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL18518167 0.89 KDM4E (0.33) KDM4EATML3MBTL1HDAC4
SCHEMBL21916589 0.89 KDM4E (0.35) KDM4EATML3MBTL1HDAC4
SCHEMBL15337948 0.89 KDM4E (0.41) KDM4EATML3MBTL1PGR
SCHEMBL18518822 0.88 — —
SCHEMBL783308 0.88 KDM4E (0.50) KDM4EATML3MBTL1PGRHDAC4
SCHEMBL21916435 0.87 KDM4E (0.33) KDM4EATML3MBTL1HDAC4
SCHEMBL18518075 0.87 KDM4E (0.40) KDM4EATML3MBTL1PGRHDAC4
SCHEMBL14328158 0.87 KDM4E (0.37) KDM4EATML3MBTL1PGRHDAC4
SCHEMBL18518711 0.87 KDM4E (0.37) KDM4EATML3MBTL1PGRHDAC4

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 2 patents. 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
WO-2017025164-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-02-16 — — WO disclosed
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