SCHEMBL10075110

SCHEMBL10075110

CC(CC(=O)O)CC(=O)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.47
ELANE P08246 3/20 0.44
CYP19A1 P11511 1/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALOX15 P16050 1/20 0.41
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL28171481 0.86 ELANE (0.44) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL27581241 0.86 ELANE (0.59) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL666155 0.83 POLB (0.47) ELANECYP19A1ALDH1A1HSD17B10ALOX15
SCHEMBL27683318 0.83 TRPA1 (0.45) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL27765405 0.83 TRPA1 (0.45) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL6237740 0.83 ELANE (0.46) FFAR1ELANECYP19A1ALDH1A1LMNA
SCHEMBL1870721 0.81 LMNA (0.50) ELANECYP19A1ALDH1A1HSD17B10ATM
SCHEMBL15870694 0.81 ELANE (0.41) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL6566817 0.81 L3MBTL1 (0.44) FFAR1ELANECYP19A1ALDH1A1ATM
SCHEMBL27581304 0.81 ELANE (0.41) FFAR1ELANECYP19A1ALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150111-B1 SUBSTITUTED 1,3-DIOXANES USEFUL AS PPAR MODULATORS EVOLVA SA (CH) 2016-10-19 EP disclosed
US-20160193179-A1 Treatment of Cardiovascular Risk in Diabetic Patients SAKARIASSEN KJELL STEINAR (IT) 2016-07-07 US disclosed
US-20160193179-A1 Treatment of Cardiovascular Risk in Diabetic Patients SAKARIASSEN KJELL STEINAR (IT) 2016-07-07 US disclosed
US-9260406-B2 Substituted 1,3-dioxanes useful as PPAR modulators EVOLVA SA (CH) 2016-02-16 US disclosed
US-9260406-B2 Substituted 1,3-dioxanes useful as PPAR modulators EVOLVA SA (CH) 2016-02-16 US disclosed
WO-2015193630-A1 TREATMENT OF CARDIOVASCULAR RISK IN PATIENTS WITH CARDIOVASCULAR DISEASE AND/OR DIABETES EVOLVA SA (CH) 2015-12-23 WO disclosed
US-20150158838-A1 Prodrugs of Substituted 1,3-Dioxanes and Their Uses EVOLVA SA (CH) 2015-06-11 US disclosed
US-20150158838-A1 Prodrugs of Substituted 1,3-Dioxanes and Their Uses EVOLVA SA (CH) 2015-06-11 US disclosed
US-8952053-B2 Prodrugs of substituted 1,3-dioxanes and their uses EVOLVA SA (CH) 2015-02-10 US disclosed
US-8952053-B2 Prodrugs of substituted 1,3-dioxanes and their uses EVOLVA SA (CH) 2015-02-10 US disclosed
US-20120142766-A1 SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2012-06-07 US disclosed
US-20100273824-A1 SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2010-10-28 US disclosed
US-20100273824-A1 SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2010-10-28 US disclosed
US-20100168169-A1 SUBSTITUTED 1,3-DIOXANES USEFUL AS PPAR MODULATORS EVOLVA SA (CH) 2010-07-01 US disclosed
US-20100168169-A1 SUBSTITUTED 1,3-DIOXANES USEFUL AS PPAR MODULATORS EVOLVA SA (CH) 2010-07-01 US disclosed
US-20100087517-A1 PRODRUGS OF SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2010-04-08 US disclosed
WO-2008089463-A2 SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2008-07-24 WO disclosed
WO-2008089462-A2 SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2008-07-24 WO disclosed
WO-2008089464-A1 PRODRUGS OF SUBSTITUTED 1,3-DIOXANES AND THEIR USES EVOLVA SA (CH) 2008-07-24 WO disclosed
WO-2008089461-A1 SUBSTITUTED 1,3-DIOXANES USEFUL AS PPAR MODULATORS EVOLVA SA (CH) 2008-07-24 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 (6 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-20160193179-A1 Treatment of Cardiovascular Risk in Diabetic Patients P2RY12, P2RY13, P2RY6 FFAR1 42/4885ELANE 1466/4885CYP19A1 3114/4885
US-20100087517-A1 PRODRUGS OF SUBSTITUTED 1,3-DIOXANES AND THEIR USES TBXA2R, PPARG, PPARA FFAR1 25/4885ELANE 1101/4885CYP19A1 28/4885
US-20120142766-A1 SUBSTITUTED 1,3-DIOXANES AND THEIR USES TBXA2R, PPARG, PPARA FFAR1 63/4885ELANE 1012/4885CYP19A1 43/4885
US-20100273824-A1 SUBSTITUTED 1,3-DIOXANES AND THEIR USES TBXA2R, PPARG, PPARA FFAR1 63/4885ELANE 1012/4885CYP19A1 43/4885
US-20100168169-A1 SUBSTITUTED 1,3-DIOXANES USEFUL AS PPAR MODULATORS PPARD, PPARG, PPARA FFAR1 13/4885ELANE 3295/4885CYP19A1 275/4885
US-20150158838-A1 Prodrugs of Substituted 1,3-Dioxanes and Their Uses TBXA2R, PPARG, PPARA FFAR1 25/4885ELANE 1101/4885CYP19A1 28/4885

“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.