SCHEMBL13285338

SCHEMBL13285338

CC1(C)c2cc(N3c4ccccc4C(C)(C)c4ccccc43)ccc2-c2cc3c(cc21)c1ccccc1n3-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HDAC4 P56524 1/20 0.32
▸ 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
SCHEMBL12116379 0.94 KDM4E (0.42) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL12116363 0.94 KDM4E (0.33) KDM4EATML3MBTL1PGR
SCHEMBL802994 0.90 KDM4E (0.38) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL12116350 0.89 KDM4E (0.49) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL12116383 0.88 KDM4E (0.33) KDM4EATML3MBTL1PGR
SCHEMBL12117248 0.88 PGR (0.35) PGR
SCHEMBL9890205 0.87 KDM4E (0.46) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL28859070 0.87 KDM4E (0.49) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL13365990 0.87 KDM4E (0.49) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL30010276 0.87 KDM4E (0.49) KDM4EATML3MBTL1HDAC4PGR

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
WO-2010083873-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-07-29 — — WO disclosed
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