SCHEMBL402501

SCHEMBL402501

CC(=O)CCC(=O)OC(CO)CO

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.57
MAPK1 P28482 1/20 0.57
ALDH1A1 P00352 2/20 0.46
FAAH O00519 1/20 0.45
HPGD P15428 1/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
PRKCA P17252 6/20 0.44
PRKCE Q02156 2/20 0.44
PRKCQ Q04759 2/20 0.44
PRKCD Q05655 2/20 0.44
LMNA P02545 1/20 0.39
SLC15A2 Q16348 1/20 0.39
MGLL Q99685 1/20 0.38

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
SCHEMBL13901278 0.88 MAPT (0.61) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL406117 0.86 PRKCA (0.63) ALDH1A1PRKCAPRKCEPRKCQPRKCD
SCHEMBL19912587 0.85 MAPT (0.43) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL21095609 0.85 MAPT (0.43) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL16020408 0.82 ALDH1A1 (0.46) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL408015 0.80 PRKCA (0.45) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL4567081 0.80 ALDH1A1 (0.43) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL542358 0.79 MAPT (0.53) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL76959 0.79 MAPT (0.70) MAPTMAPK1ALDH1A1FAAHHPGD
SCHEMBL491496 0.79 MGAM (0.50) MAPTMAPK1ALDH1A1FAAHHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3212687-B1 HIGH RECYCLE CONTENT POLYESTER POLYOLS FROM HYDROXY-FUNCTIONAL KETAL ACIDS, ESTERS OR AMIDES RESINATE MAT GROUP INC (US) 2019-02-20 EP claimed
US-20170335057-A1 HIGH RECYCLE CONTENT POLYESTER POLYOLS FROM HYDROXY-FUNCTIONAL KETAL ACIDS, ESTERS OR AMIDES RESINATE MATERIALS GROUP, INC. 2017-11-23 US claimed
EP-3212687-A1 HIGH RECYCLE CONTENT POLYESTER POLYOLS FROM HYDROXY-FUNCTIONAL KETAL ACIDS, ESTERS OR AMIDES Resinate Materials Group, Inc. (US) 2017-09-06 EP claimed
WO-2016069622-A1 HIGH RECYCLE CONTENT POLYESTER POLYOLS FROM HYDROXY-FUNCTIONAL KETAL ACIDS, ESTERS OR AMIDES RESINATE MATERIALS GROUP, INC. (US) 2016-05-06 WO claimed
US-20100312006-A1 PRODUCTION OF LEVULINIC ACID AND LEVULINATE ESTERS FROM BIOMASS MEADWESTVACO CORPORATION (US) 2010-12-09 US claimed
CN-110872539-A Method for preparing water-based lubricating oil by utilizing levulinic acid 北京化工大学 2020-03-10 CN disclosed
CN-110872539-A Method for preparing water-based lubricating oil by utilizing levulinic acid 北京化工大学 2020-03-10 CN disclosed
CN-105085170-B The method that glycerol and levulic acid one-step method prepare 1,3- propylene glycol and gamma-valerolactone 南开大学 2019-06-07 CN disclosed
CN-105085170-B The method that glycerol and levulic acid one-step method prepare 1,3- propylene glycol and gamma-valerolactone 南开大学 2019-06-07 CN disclosed
EP-3212703-B1 POLYMERIC PLASTICIZER COMPOSITIONS RESINATE MAT GROUP INC (US) 2019-05-01 EP disclosed
EP-3212687-B1 HIGH RECYCLE CONTENT POLYESTER POLYOLS FROM HYDROXY-FUNCTIONAL KETAL ACIDS, ESTERS OR AMIDES RESINATE MAT GROUP INC (US) 2019-02-20 EP disclosed
CN-107973932-A A kind of new plasticizer and preparation method thereof and the purposes in PVC hose is prepared 浙江沪天胶带有限公司 2018-05-01 CN disclosed
EP-1954140-A2 GLYCEROL LEVULINATE KETALS AND THEIR USE Aromagen Corporation (US) 2008-08-13 EP disclosed
WO-2007062118-A3 GLYCEROL LEVULINATE KETALS AND THEIR USE AROMAGEN CORP (US) 2007-11-29 WO disclosed
WO-2007062118-A2 GLYCEROL LEVULINATE KETALS AND THEIR USE AROMAGEN CORPORATION (US) 2007-05-31 WO disclosed
WO-2007062118-A2 GLYCEROL LEVULINATE KETALS AND THEIR USE AROMAGEN CORPORATION (US) 2007-05-31 WO disclosed
US-20050266068-A1 Cardiolipin molecules and methods of synthesis NEOPHARM, INC. (US) 2005-12-01 US disclosed
EP-1556392-A1 CARDIOLIPIN MOLECULES AND METHOD OF SYNTHESIS Neopharm, Inc. (US) 2005-07-27 EP disclosed
WO-2004039817-A9 CARDIOLIPIN MOLECULES AND METHOD OF SYNTHESIS NEOPHARM INC (US) 2004-07-22 WO disclosed
WO-2004039817-A1 CARDIOLIPIN MOLECULES AND METHOD OF SYNTHESIS NEOPHARM, INC. (US) 2004-05-13 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 (1 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-20050266068-A1 Cardiolipin molecules and methods of synthesis PHOSPHO1, MGLL, LIPA MAPT 4872/4885MAPK1 1813/4885ALDH1A1 4029/4885

“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.