SCHEMBL22986789

SCHEMBL22986789

CC1CCCCC1(C)C#N

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
MAPT P10636 1/20 0.33
PDE4A P27815 2/20 0.32
ALDH1A1 P00352 2/20 0.31
GLA P06280 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
DPP4 P27487 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
Cyanide SCHEMBL27486314 0.96 PDE4A (0.33) KDM4EMAPTPDE4A
SCHEMBL16386240 0.93
SCHEMBL11331875 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8727418 0.77
SCHEMBL5528421 0.76 KDM4E (0.36) KDM4EMAPTALDH1A1
SCHEMBL29373374 0.74 KDM4E (0.35) KDM4EMAPT
SCHEMBL10727389 0.74
SCHEMBL3267805 0.74 KDM4E (0.35) KDM4EMAPT
SCHEMBL11578772 0.74
SCHEMBL25758305 0.72 KDM4E (0.31) KDM4EMAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103910829-A rubber composition and golf ball CHI MEI CORP 2014-07-09 CN claimed
US-20210047182-A1 PROCESS FOR MANUFACTURING AN AQUEOUS HYDROGEN PEROXIDE SOLUTION SOLVAY SA (BE) 2021-02-18 US disclosed
CN-103910829-B rubber composition and golf ball 奇美实业股份有限公司 2016-09-21 CN disclosed
CN-103183758-B Modified high-cis conjugated diene polymer and method for producing same CHI MEI CORP 2015-07-08 CN disclosed
CN-103183778-B Backbone-modified conjugated diene-vinyl aromatic hydrocarbon copolymer and preparation method thereof CHI MEI CORP 2015-03-25 CN disclosed
CN-103910829-A rubber composition and golf ball CHI MEI CORP 2014-07-09 CN disclosed
CN-103910915-A rubber composition and method for producing same CHI MEI CORP 2014-07-09 CN disclosed
CN-103183778-A Backbone-modified conjugated diene-vinyl aromatic hydrocarbon copolymer and preparation method thereof CHI MEI CORP 2013-07-03 CN disclosed
CN-103183758-A Modified high-cis conjugated diene polymer and method for producing same CHI MEI CORP 2013-07-03 CN disclosed