SCHEMBL20727144

SCHEMBL20727144

CCN(c1c(C)c(Br)cc2cn[nH]c12)C1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 13/20 0.34
▸ EED O75530 9/20 0.34
▸ RBBP4 Q09028 9/20 0.34
▸ SUZ12 Q15022 9/20 0.34
▸ AEBP2 Q6ZN18 9/20 0.34
▸ EZH1 Q92800 1/20 0.34
▸ CRHR1 P34998 2/20 0.33
▸ PDE4B Q07343 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ IDO1 P14902 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ PDE6D O43924 1/20 0.31
▸ PDE6A P16499 1/20 0.31
▸ PDE6G P18545 1/20 0.31
▸ PDE6B P35913 1/20 0.31
▸ PDE6C P51160 1/20 0.31
▸ PDE6H Q13956 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31

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
SCHEMBL20727202 0.82 PDE4B (0.34) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20727204 0.72 EZH2 (0.35) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20727168 0.71 PDE4B (0.43) PDE4BKMT2AIDO1HDAC1HDAC6
SCHEMBL28466809 0.71 EZH2 (0.41) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20727206 0.69 EZH2 (0.33) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL20727150 0.69 PDE4B (0.33) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL25933018 0.64 GBA1 (0.51) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL18365032 0.64 EZH2 (0.55) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL29180269 0.64 EZH2 (0.39) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL27074905 0.63 JAK2 (0.33) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3441388-A1 4,5,6-TRI-SUBSTITUTED INDAZOLES DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN MEDICINES Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2019-02-13 — — EP disclosed
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