SCHEMBL14715973

SCHEMBL14715973

CCCC(C)C1OC(=O)CC1C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.34
NAAA Q02083 1/20 0.31
CYP1A2 P05177 3/20 0.31

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
SCHEMBL10110367 0.77 SMN1; SMN2 (0.48) SMN1; SMN2THRBALOX15
SCHEMBL16369092 0.77 SMN1; SMN2 (0.48) SMN1; SMN2THRBALOX15
SCHEMBL29884708 0.76 NAAA (0.30) NAAA
SCHEMBL9254839 0.76 NAAA (0.30) NAAA
SCHEMBL22591175 0.72 THRB (0.36) SMN1; SMN2THRBALOX15
SCHEMBL17867124 0.72 HTT (0.31)
SCHEMBL29134113 0.70 CYP1A2 (0.43) SMN1; SMN2CYP1A2
SCHEMBL15964115 0.69 SMN1; SMN2 (0.36) SMN1; SMN2THRBALOX15
SCHEMBL14994441 0.68 SMN1; SMN2 (0.43) SMN1; SMN2CYP1A2
SCHEMBL7178100 0.68 SMN1; SMN2 (0.43) SMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2748353-A2 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF -HYDROXYCARBOXYLIC ESTERS AND -LACTONES BASF SE (DE) 2014-07-02 EP claimed
US-20140100376-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2014-04-10 US claimed
US-20130053582-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2013-02-28 US claimed
WO-2013026737-A2 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF Γ-HYDROXYCARBOXYLIC ESTERS AND Γ-LACTONES BASF SE (DE) 2013-02-28 WO claimed
EP-2748353-B1 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2017-04-26 EP disclosed
EP-2748353-B1 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2017-04-26 EP disclosed
EP-2748353-A2 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF -HYDROXYCARBOXYLIC ESTERS AND -LACTONES BASF SE (DE) 2014-07-02 EP disclosed
US-20140100376-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2014-04-10 US disclosed
US-8617376-B2 Process for the electrochemical preparation of gamma-hydroxycarboxylic esters and gamma-lactones BASF SE (DE) 2013-12-31 US disclosed
US-20130053582-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2013-02-28 US disclosed
US-20130053582-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2013-02-28 US disclosed
US-20130053582-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES BASF SE (DE) 2013-02-28 US disclosed
WO-2013026737-A2 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF Γ-HYDROXYCARBOXYLIC ESTERS AND Γ-LACTONES BASF SE (DE) 2013-02-28 WO disclosed
WO-2013026737-A2 METHOD FOR THE ELECTROCHEMICAL PRODUCTION OF Γ-HYDROXYCARBOXYLIC ESTERS AND Γ-LACTONES BASF SE (DE) 2013-02-28 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 (2 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-20130053582-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES HBZ, HBG1, EBP SMN1; SMN2 3776/4885THRB 251/4885ALOX15 463/4885
US-20140100376-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF GAMMA-HYDROXYCARBOXYLIC ESTERS AND GAMMA-LACTONES HBZ, HBG1, EBP SMN1; SMN2 3776/4885THRB 251/4885ALOX15 463/4885

“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.