SCHEMBL28090209

SCHEMBL28090209

CCC(C)C(C(=O)O)C(C(=O)O)C(C)CC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
ACE P12821 3/20 0.43
MME P08473 2/20 0.43
CPA1 P15085 2/20 0.43
ACE2 Q9BYF1 2/20 0.43
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA2 P00918 1/20 0.37

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
SCHEMBL20753231 0.92 ALDH1A1 (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL3499612 0.89 ALDH1A1 (0.42) ALDH1A1ACEMMECPA1ACE2
SCHEMBL13311446 0.89 ALDH1A1 (0.42) ALDH1A1ACEMMECPA1ACE2
SCHEMBL21571925 0.88 CHRM1 (0.46) ALDH1A1ACEMMECPA1ACE2
SCHEMBL7546505 0.87 ALDH1A1 (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL2625119 0.87 ALDH1A1 (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL8569856 0.87 TP53 (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL7546501 0.87 ALDH1A1 (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL13145129 0.85 TSHR (0.41) ALDH1A1ACEMMECPA1ACE2
SCHEMBL14748307 0.85 TSHR (0.41) ALDH1A1ACEMMECPA1ACE2

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-106164111-B Catalyst system for olefinic polymerization 沙特基础工业公司 2018-12-18 CN disclosed
CN-105940022-B Catalyst system for olefinic polymerization 沙特基础工业公司 2018-07-31 CN disclosed
CN-105940019-B For the catalyst system of olefinic polymerization 沙特基础工业公司 2018-05-18 CN disclosed
CN-105940018-B For the raw catalyst of olefinic polymerization 沙特基础工业公司 2018-05-18 CN disclosed
CN-106164111-A Catalyst system for olefinic polymerization 沙特基础工业公司 2016-11-23 CN disclosed
CN-105940022-A Catalyst system for polymerization of an olefin 沙特基础工业公司 2016-09-14 CN disclosed
CN-105940019-A CATALYST SYSTEM FOR POLYMERIZATION OF AN OLEFIN 沙特基础工业公司 2016-09-14 CN disclosed
CN-105940018-A Procatalyst for polymerization of olefins 沙特基础工业公司 2016-09-14 CN disclosed
CN-105940021-A Catalyst system for olefin polymerization 沙特基础工业公司 2016-09-14 CN disclosed