SCHEMBL2354896

SCHEMBL2354896

CCCC[C](C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 9/20 0.72
CES1 P23141 9/20 0.72
PTGS2 P35354 1/20 0.53
ALDH1A1 P00352 1/20 0.50
NAAA Q02083 1/20 0.47
ESR1 P03372 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HSD17B3 P37058 1/20 0.44

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
SCHEMBL28578490 0.85 CES2 (0.79) CES2CES1PTGS2ALDH1A1NAAA
SCHEMBL7219046 0.84 CES1 (1.00) CES2CES1PTGS2ALDH1A1NAAA
SCHEMBL27480440 0.81 CES2 (0.68) CES2CES1PTGS2ALDH1A1NAAA
SCHEMBL28378143 0.79 CES2 (0.80) CES2CES1PTGS2NAAAL3MBTL1
Valerophenone SCHEMBL50014 0.79 L3MBTL1 (0.72) CES2CES1PTGS2L3MBTL1LMNA
Valerophenone SCHEMBL9725402 0.79 L3MBTL1 (0.72) CES2CES1PTGS2L3MBTL1LMNA
Valerophenone SCHEMBL5615151 0.79 L3MBTL1 (0.72) CES2CES1PTGS2L3MBTL1LMNA
SCHEMBL7219754 0.78 CES2 (1.00) CES2CES1PTGS2NAAAL3MBTL1
Benzil SCHEMBL337491 0.78 CES2 (0.74) CES2CES1ALDH1A1LMNAMAPT
SCHEMBL5698577 0.78 CES2 (0.81) CES2CES1PTGS2NAAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9981008-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2018-05-29 US disclosed
EP-2939683-B1 Apolipoprotein A-I Mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2017-01-04 EP disclosed
US-20160324923-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2016-11-10 US disclosed
US-9388232-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2016-07-12 US disclosed
EP-2939683-A1 Apolipoprotein A-I Mimics Cerenis Therapeutics Holding SA (FR) 2015-11-04 EP disclosed
EP-2396017-B1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2015-07-01 EP disclosed
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2015-05-21 US disclosed
CN-104530223-A Apolipoprotein A-I mimics CERENIS THERAPEUTICS SA 2015-04-22 CN disclosed
US-8993597-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2015-03-31 US disclosed
CN-102395375-B Apolipoprotein A-I mimetics CERENIS THERAPEUTICS SA 2015-01-14 CN disclosed
CN-102395375-A Apolipoprotein A-I mimetics CERENIS THERAPEUTICS SA 2012-03-28 CN disclosed
EP-2396017-A1 APOLIPOPROTEIN A-I MIMICS Cerenis Therapeutics SA (FR) 2011-12-21 EP disclosed
US-7994120-B2 Administering to a subject an apolipoprotein-sphingomyelin complex comprising an apolipoprotein and the lipid sphingomyelin in an amount effective to achieve a serum level of free or complexed apolipoprotein in the range of 30 mg/dL to 300 mg/dL after administration; treatment of cardiovascular disease PFIZER, INC. (US) 2011-08-09 US disclosed
US-20100267631-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2010-10-21 US disclosed
WO-2010093918-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS SA (FR) 2010-08-19 WO disclosed
EP-1511508-A4 METHOD OF TREATING DYSLIPIDEMIC DISORDERS ESPERION THERAPEUTICS INC (US) 2009-07-08 EP disclosed
US-20080269111-A1 METHOD OF TREATING DYSLIPIDEMIC DISORDER PFIZER INC 2008-10-30 US disclosed
EP-1511508-A2 METHOD OF TREATING DYSLIPIDEMIC DISORDERS Esperion Therapeutics Inc. (US) 2005-03-09 EP disclosed
US-20040067873-A1 Method of treating dyslipidemic disorders PFIZER INC. 2004-04-08 US disclosed
WO-2003096983-A2 METHOD OF TREATING DYSLIPIDEMIC DISORDERS ESPERION THERAPEUTICS, INC. (US) 2003-11-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100267631-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG CES2 2754/4885CES1 249/4885PTGS2 3987/4885
US-20160324923-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG CES2 2754/4885CES1 249/4885PTGS2 3987/4885
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG CES2 2754/4885CES1 249/4885PTGS2 3987/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.