SCHEMBL406807

SCHEMBL406807

CCCC(OC(=O)CC)OC(=O)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 2/20 0.37
TSHR P16473 2/20 0.37
NFKB1 P19838 2/20 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
SCHEMBL17453517 0.89 ALDH1A1 (0.36) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL28515601 0.88 NAAA (0.34) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL20293875 0.87 ALDH1A1 (0.34) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL4831343 0.86 SMPD1 (0.48) NAAALMNAFAAHCNR1CNR2
SCHEMBL20293876 0.85 NAAA (0.35) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL20293872 0.82 NAAA (0.41) ALDH1A1NAAALMNAFAAHCNR1
SCHEMBL632803 0.81 TSHR (0.42) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL7113121 0.81 HTR2C (0.36) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL11686100 0.81 FAAH (0.43) ALDH1A1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL28650164 0.80 MEN1 (0.46) ALDH1A1CHRM1AKR1A1CHRM3HTR2A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0349301-A2 Positive-type photoresist composition MITSUBISHI KASEI CORPORATION (JP) 1990-01-03 EP claimed
EP-2415847-B1 METHOD FOR PRODUCING ALUMINIUM OXIDE PHOSPHOR UNIV HIROSHIMA (JP) 2014-12-31 EP disclosed
CN-103800300-A Methods of reducing alcohol-induced dose dumping for opioid sustained release oral dosage forms ALZA CORP 2014-05-21 CN disclosed
US-8652358-B2 Aluminum oxide phosphor and method for producing the same HIROSHIMA UNIVERSITY (JP) 2014-02-18 US disclosed
EP-2415847-A1 ALUMINUM OXIDE PHOSPHOR AND METHOD FOR PRODUCING SAME Hiroshima University (JP) 2012-02-08 EP disclosed
US-20120018675-A1 ALUMINUM OXIDE PHOSPHOR AND METHOD FOR PRODUCING THE SAME KURARAY CO., LTD. (JP) 2012-01-26 US disclosed
CN-1892926-B Conductive paste for multilayer electronic component and multilayer electronic component using the same SHOEI CHEMICAL IND CO 2010-07-14 CN disclosed
CN-101351202-A Method of reducing alcohol-induced dose dumping of opioid sustained release oral dosage forms ALZA CORP (US) 2009-01-21 CN disclosed
CN-101232868-A Combination of tramadol and substances that comprise gabapentin ALZA CORP (US) 2008-07-30 CN disclosed
CN-1905856-A Methods and dosage forms for increasing solubility of controlled delivery pharmaceutical compositions ALZA CORP (US) 2007-01-31 CN disclosed
CN-1901879-A Administration of levodopa and carbidopa ALZA CORP (US) 2007-01-24 CN disclosed
CN-1892926-A Conductive paste for multilayer electronic component and multilayer electronic component using the same SHOEI CHEMICAL IND CO (JP) 2007-01-10 CN disclosed
CN-1684670-A Methods and dosage forms for controlled delivery of paliperidone ALZA CORP (US) 2005-10-19 CN disclosed
CN-1671358-A Dosage forms and compositions for osmotic delivery of variable dosages of oxycodone ALZA CORP (US) 2005-09-21 CN disclosed
CN-1665482-A Methods and dosage forms for controlled delivery of oxycodone ALZA CORP (US) 2005-09-07 CN disclosed
CN-1620281-A Formulation & dosage form for the controlled delivery of therapeutic agents ALZA CORP (US) 2005-05-25 CN disclosed
CN-1161101-C Conversion of liquid filled gelatin capsules into controlled release systems by multiple coatings 2004-08-11 CN disclosed
CN-1331580-A Conversion of liquid-filled gelatin capsules into controlled release systems with multiple coatings ALZA CORP (US) 2002-01-16 CN disclosed
CN-1325301-A Controlled delivery of active agents ALZA CORP (US) 2001-12-05 CN disclosed
EP-0349301-A2 Positive-type photoresist composition MITSUBISHI KASEI CORPORATION (JP) 1990-01-03 EP disclosed