SCHEMBL18518816

SCHEMBL18518816

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc(-c5cccc6c5c5ccccc5n6-c5ccccc5)c4)c3cc21

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL18518822 0.95 — —
SCHEMBL21012359 0.91 PTGER4 (0.31) KDM4EATML3MBTL1
SCHEMBL18518229 0.91 KDM4E (0.38) KDM4EATML3MBTL1
SCHEMBL15806085 0.90 PTGER4 (0.31) RXFP1
SCHEMBL18518736 0.90 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL18518071 0.90 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL18518909 0.90 L3MBTL1 (0.33) KDM4EATML3MBTL1
SCHEMBL18518908 0.89 — —
SCHEMBL18518162 0.89 PTGER4 (0.34) KDM4EATML3MBTL1
SCHEMBL18518232 0.89 KDM4E (0.34) KDM4EATML3MBTL1

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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