SCHEMBL2269296

SCHEMBL2269296

CCCOC(CC)OC(=O)CC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.36
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
ESR1 P03372 1/20 0.31
HIF1A Q16665 1/20 0.31
LMNA P02545 2/20 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
SCHEMBL28702421 0.88 NAAA (0.42) NAAAALDH1A1LMNA
SCHEMBL20293876 0.86 NAAA (0.35) NAAAALDH1A1MEN1CYP2C19RECQL
SCHEMBL28770404 0.86 ALDH1A1 (0.43) ALDH1A1LMNA
SCHEMBL4499231 0.83 MEN1 (0.35) NAAAALDH1A1MEN1CYP2C19RECQL
SCHEMBL27710504 0.82 LMNA (0.47) ALDH1A1MEN1KMT2AHIF1ALMNA
SCHEMBL1362097 0.82 CYP2C19 (0.39) NAAAALDH1A1MEN1CYP2C19RECQL
SCHEMBL2253998 0.81 TSHR (0.37) ALDH1A1LMNA
SCHEMBL10807824 0.79 TSHR (0.31)
SCHEMBL9004287 0.79 LMNA (0.35) LMNA
SCHEMBL783931 0.78 NAAA (0.39) NAAAALDH1A1MEN1CYP2C19RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118510877-A Cleaning composition for pretreatment of metal substrates, method for the production thereof and use thereof 巴斯夫涂料有限公司 2024-08-16 CN disclosed
WO-2023131530-A1 A CLEANING COMPOSITION FOR METAL SUBSTRATES PRETREATMENT AND ITS PREPARATION METHOD AND APPLICATION THEREOF BASF COATINGS GMBH (DE) 2023-07-13 WO disclosed
US-8741809-B2 Liquid pyraclostrobin-containing crop protection formulations BASF SE (DE) 2014-06-03 US disclosed
CN-101220229-B Dye dispersion liquid DAICEL CHEM 2012-05-23 CN disclosed
US-20110195846-A1 Liquid Pyraclostrobin-Containing Crop Protection Formulations BASF SE (DE) 2011-08-11 US disclosed
CN-101220229-A Dye dispersion liquid DAICEL CHEM (JP) 2008-07-16 CN disclosed