SCHEMBL31700

SCHEMBL31700

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-n4c5ccccc5c5ccc6c(c54)C(C)(C)c4ccccc4-6)cc3)cc21

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL17231168 0.96
SCHEMBL22959459 0.95
SCHEMBL31756 0.95 KDM4E (0.33) HDAC4
SCHEMBL31655 0.94 KDM4E (0.35) HDAC4
SCHEMBL31713 0.94 KDM4E (0.32) HDAC4
SCHEMBL31849 0.94 KDM4E (0.32) HDAC4
SCHEMBL10014068 0.93
SCHEMBL15752451 0.93
SCHEMBL22959504 0.93
SCHEMBL17880958 0.92 DUSP3 (0.32) HDAC4

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-2012026780-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-01 WO disclosed