SCHEMBL4527336

SCHEMBL4527336

C=CCC(=O)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.43
GLO1 Q04760 1/20 0.43
ALDH1A1 P00352 6/20 0.42
TSHR P16473 1/20 0.42
FAAH O00519 2/20 0.42
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2D6 P10635 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
CYP2C9 P11712 1/20 0.36
HCAR2 Q8TDS4 1/20 0.35

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
SCHEMBL27823234 0.87 NPSR1 (0.41) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL28064776 0.82 NPSR1 (0.43) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL9395715 0.82 NPSR1 (0.43) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL2358456 0.80 ALDH1A1 (0.45) NPSR1GLO1ALDH1A1TSHRLMNA
SCHEMBL14642009 0.79 NPSR1 (0.35) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL4107223 0.79 NPSR1 (0.45) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL1651451 0.79 CYP3A4 (0.41) NPSR1ALDH1A1TSHRHSD17B10SMN1; SMN2
SCHEMBL873301 0.78 FAAH (0.51) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL10997210 0.78 NPSR1 (0.41) NPSR1GLO1ALDH1A1TSHRFAAH
SCHEMBL6446270 0.78 TSHR (0.55) NPSR1ALDH1A1TSHRFAAHLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250186408-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2025-06-12 US disclosed
EP-4333819-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY Katholieke Universiteit Leuven (BE) 2024-03-13 EP disclosed
WO-2022233877-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-11-10 WO disclosed
US-20140315829-A1 Compositions And Methods For Enhancing Sialic Acid Levels In Tissue THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2014-10-23 US disclosed
US-20140057856-A1 Compositions and Methods For Enhancing Sialic Acid Levels In Tissue THE REGENTS OF THE UNIVERSTIY OF CALIFORNIA (US) 2014-02-27 US disclosed
US-20090124506-A1 Membrane computing TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-05-14 US disclosed
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP 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-20250186408-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY CNR1, CNR2, CYP2J2 NPSR1 233/4885GLO1 3004/4885ALDH1A1 1412/4885

“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.