SCHEMBL28466809

SCHEMBL28466809

CCN(c1c(C)c(Br)cc(C(=O)O)c1C)C1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 18/20 0.41
▸ EED O75530 8/20 0.41
▸ RBBP4 Q09028 8/20 0.41
▸ SUZ12 Q15022 8/20 0.41
▸ AEBP2 Q6ZN18 8/20 0.41
▸ EZH1 Q92800 1/20 0.41
▸ IDO1 P14902 1/20 0.36

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
SCHEMBL29180269 0.85 EZH2 (0.39) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL29613562 0.81 EZH2 (0.60) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL13276540 0.81 EZH2 (0.60) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL24072862 0.78 EZH2 (0.47) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19964350 0.75 EZH2 (0.65) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL21689406 0.75 EZH2 (0.45) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL13276707 0.74 EZH2 (0.44) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL13277238 0.74 EZH2 (0.51) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL16935339 0.74 EZH2 (0.42) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL16213153 0.73 EED (0.57) EZH2EEDRBBP4SUZ12AEBP2

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
CN-116655612-A Synthetic method and application of EZH2 inhibitor 王亚男 2023-08-29 — — CN disclosed
CN-105829302-B Hydrochloride salt form for EZH2 inhibition EPIZYME股份有限公司 2020-09-08 — — CN disclosed
Send feedback