SCHEMBL28128355

SCHEMBL28128355

CCCC(C(=O)OC)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.44
CA2 P00918 3/20 0.44
CTSK P43235 8/20 0.39
CTSS P25774 2/20 0.39
ZDHHC7 Q9NXF8 1/20 0.38
CA12 O43570 3/20 0.37
CA14 Q9ULX7 3/20 0.37
DGAT1 O75907 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CA7 P43166 2/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
BIRC2 Q13490 1/20 0.32

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
SCHEMBL3325978 0.92 CTSK (0.39) CA1CA2CTSKCTSSCA12
SCHEMBL28926772 0.89 CA1 (0.55) CA1CA2CTSKCTSSZDHHC7
SCHEMBL29284270 0.86 ZDHHC7 (0.53) CA1CA2CTSKZDHHC7MEN1
SCHEMBL2946633 0.85 CA1 (0.50) CA1CA2ZDHHC7CA14GAA
SCHEMBL31604 0.84 CHRM1 (0.43) CA1CA2CTSKCTSSCA12
SCHEMBL4477961 0.84 CA1 (0.42) CA1CA2CTSKCTSSZDHHC7
SCHEMBL2443295 0.83 CA12 (0.36) CA1CA2ZDHHC7CA12CA14
SCHEMBL2443294 0.83 CA12 (0.36) CA1CA2ZDHHC7CA12CA14
SCHEMBL27542596 0.83 CA12 (0.36) CA1CA2CTSKZDHHC7CA12
SCHEMBL27649619 0.83 CTSK (0.35) CA1CA2CTSKCTSSCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104513330-B A kind of catalyst systems for olefin polymerization and its application 中国石油化工股份有限公司 2017-07-28 CN disclosed
CN-104513332-B Catalyst system and its application for olefinic polymerization 中国石油化工股份有限公司 2017-06-06 CN disclosed
CN-104513327-B Olefin polymerization catalyst composition and applications thereof 中国石油化工股份有限公司 2017-02-15 CN disclosed