SCHEMBL5597686

SCHEMBL5597686

CC(O)C/C(C(=O)O)=C(/CC(C)O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
GRIK1 P39086 2/20 0.39
GRIA4 P48058 1/20 0.37
GRIK3 Q13003 1/20 0.37
GRIK5 Q16478 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
TET2 Q6N021 1/20 0.33

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
SCHEMBL5597687 1.00 TP53 (0.40) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL8051853 1.00 TP53 (0.40) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL7779212 0.90 GRIK1 (0.41) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL7779220 0.90 GRIK1 (0.41) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL27220816 0.87 GRIK1 (0.56) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL610561 0.79 ALDH1A1 (0.50) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL610562 0.79 ALDH1A1 (0.50) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL4620869 0.79 ALDH1A1 (0.50) TP53GRIK1GRIA4GRIK3GRIK5
SCHEMBL8778791 0.77 ALDH1A1 (0.48) GRIK1GRIA4GRIK3GRIK5ALDH1A1
SCHEMBL16059953 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210379-B1 BIODEGRADABLE POLY(PROPYLENE FUMARATE) NETWORKS CROSS LINKED WITH POLY(PROPYLENE FUMARATE)-DIACRYLATE MACROMERS UNIV WM MARSH RICE (US) 2007-03-21 EP claimed
EP-1171006-B1 FUNCTIONALIZED POLY(PROPYLENE FUMARATE) AND POLY(PROPYLENE FUMARATE-CO-ETHYLENE GLYCOL) UNIV WM MARSH RICE (US) 2006-03-29 EP claimed
US-9469941-B2 Paraben derivatives for preserving cellulosic materials EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2016-10-18 US disclosed
US-20130004785-A1 PARABEN DERIVATIVES FOR PRESERVING CELLULOSIC MATERIALS CRESTLINE DIRECT FINANCE, L.P. 2013-01-03 US disclosed
EP-0786495-B1 Thermoplastic polyester resin stretched film OJI YUKA SYNT PAPER CO LTD (JP) 2000-04-12 EP disclosed
US-5677055-A POLYESTER RESIN, MODIFIED OLEFIN OBTAINED BY GRAFT POLYMERIZING ALPHA, BETA-UNSATURATED CARBOXYLATE MONOMER CONTAINING HYDROXYL GROUPS AND AROMATIC VINYL MONOMER ONTO OLEFIN, POLYETHYLENE, EPOXY RESIN; RECORDING PAPER SUPPORT OJI-YUKA SYNTHETIC PAPER CO., LTD. (JP) 1997-10-14 US disclosed
EP-0786495-A2 Thermoplastic polyester resin stretched film OJI-YUKA SYNTHETIC PAPER CO., LTD. (JP) 1997-07-30 EP disclosed
EP-0612773-B1 Thermoplastic resin composition and process for preparing modified polyolefin type resin MITSUBISHI CHEM CORP (JP) 1996-12-27 EP disclosed
US-5424359-A Aromatic vinyl polymer having alpha, beta-unsaturated carboxylate having a hydroxyl group grafted onto it, and saturated polyester MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1995-06-13 US disclosed
EP-0612773-A1 Thermoplastic resin composition and process for preparing modified polyolefin type resin MITSUBISHI CHEMICAL CORPORATION (JP) 1994-08-31 EP disclosed
US-4584344-A POLYAMIDE MATRIX AND SHELL-CORE POLYMER CONTAINING CROSSLINKED ELAATOMER CORE AND SHELL OF UNSATURATED ACID, AND STYRENE MONSANTO COMPANY (US) 1986-04-22 US 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-20130004785-A1 PARABEN DERIVATIVES FOR PRESERVING CELLULOSIC MATERIALS CDC73, MGAM, PAXBP1 TP53 1840/4885GRIK1 4775/4885GRIA4 4722/4885

“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.