SCHEMBL16935348

SCHEMBL16935348

CCN(c1cc(-c2ccc(N3CCOCC3)nc2)cc(C(=O)O)c1C)C1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 18/20 0.61
▸ HDAC1 Q13547 2/20 0.56
▸ HDAC6 Q9UBN7 2/20 0.56

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
SCHEMBL16935400 0.94 EZH2 (0.69) EZH2HDAC1HDAC6
SCHEMBL16935205 0.92 EZH2 (0.60) EZH2HDAC1HDAC6
SCHEMBL16935294 0.91 EZH2 (0.61) EZH2HDAC1HDAC6
SCHEMBL17136164 0.90 EZH2 (0.65) EZH2HDAC1HDAC6
SCHEMBL17136167 0.90 EZH2 (0.65) EZH2HDAC1HDAC6
SCHEMBL30688045 0.89 EZH2 (0.56) EZH2HDAC1HDAC6
SCHEMBL16398434 0.89 EZH2 (0.56) EZH2HDAC1HDAC6
SCHEMBL13281854 0.86 EZH2 (0.68) EZH2HDAC1HDAC6
Formic Acid SCHEMBL13276938 0.86 EZH2 (0.54) EZH2HDAC1HDAC6
SCHEMBL28533361 0.86 EZH2 (0.68) EZH2

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-2015110999-A1 EZH2 INHIBITORS AND USES THEREOF Piramal Enterprises Limited (IN) 2015-07-30 — — WO disclosed
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