SCHEMBL18518704

SCHEMBL18518704

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc(-c5ccccc5)c(-n5c6ccccc6c6ccccc65)c4)c3cc21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.31
▸ PGR P06401 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
SCHEMBL18518713 0.92 KDM4E (0.34) KDM4EATML3MBTL1HSD17B10
SCHEMBL18518984 0.92 KDM4E (0.34) KDM4EATML3MBTL1HSD17B10
SCHEMBL18518923 0.91 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL18518169 0.90 KDM4E (0.38) KDM4EATML3MBTL1PGR
SCHEMBL16282970 0.89 KDM4E (0.38) KDM4EATML3MBTL1HSD17B10PGR
SCHEMBL14822260 0.89 KDM4E (0.38) KDM4EATML3MBTL1HSD17B10PGR
SCHEMBL18519179 0.89 KDM4E (0.38) KDM4EATML3MBTL1PGR
SCHEMBL15137503 0.89 PDK2 (0.37) KDM4EATML3MBTL1PGR
SCHEMBL14886304 0.89 KDM4E (0.35) KDM4EATML3MBTL1HSD17B10PGR
SCHEMBL782525 0.88 L3MBTL1 (0.41) KDM4EATML3MBTL1HSD17B10PGR

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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