SCHEMBL3671879

SCHEMBL3671879

O=C(O)CCCCCCN1C(=O)CC[C@@H]1/C=C/[C@@H](O)C(F)(F)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 20/20 0.79
PTGER3 P43115 10/20 0.79
PTGER2 P43116 8/20 0.70
PTGER1 P34995 2/20 0.66

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
SCHEMBL3671882 1.00 PTGER4 (0.79) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3136075 0.94 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2205857 0.94 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2205865 0.94 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3675931 0.92 PTGER4 (0.81) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3675928 0.92 PTGER4 (0.81) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3674265 0.90 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3674263 0.90 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL13658272 0.90 PTGER4 (0.71) PTGER4PTGER3PTGER2PTGER1
SCHEMBL15033741 0.89 PTGER4 (0.63) PTGER4PTGER3PTGER2PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130317013-A1 EP4 RECEPTOR AGONIST, COMPOSITIONS AND METHODS THEREOF BILLOT XAVIER (CA) 2013-11-28 US claimed
EP-1513589-B1 1,5-DISUBSTITUTED PYRROLID-2-ONE DERIVATIVES FOR USE AS EP4 RECEPTOR AGONISTS IN THE TREATMENT OF EYE DISEASES SUCH AS GLAUCOMA MERCK FROSST CANADA LTD (CA) 2010-11-10 EP claimed
US-20090258918-A1 EP4 receptor agonist, compositions and methods thereof BILLOT XAVIER 2009-10-15 US claimed
US-20050239872-A1 1,5-distributed pyrrolid-2-one derivatives for use as ep4 receptor agonists in the teatment of eye diseases such as glaucoma MERCK FROSST CANADA LTD. (CA) 2005-10-27 US claimed
US-20220242893-A1 AMIDE-LINKED CONJUGATE COMPOUNDS AND USES THEREOF UNIV FRASER SIMON (CA) 2022-08-04 US disclosed
US-11312737-B2 Amide-linked EP4 agonist-bisphosphonate compounds and uses thereof SIMON FRASER UNIVERSITY (CA) 2022-04-26 US disclosed
US-20190345179-A1 AMIDE-LINKED EP4 AGONIST-BISPHOSPHONATE COMPOUNDS AND USES THEREOF UNIV FRASER SIMON (CA) 2019-11-14 US disclosed
US-10400000-B2 Amide-linked EP4 agonist-bisphosphonate compounds and uses thereof SIMON FRASER UNIVERSITY (CA) 2019-09-03 US disclosed
US-20180170951-A1 AMIDE-LINKED EP4 AGONIST-BISPHOSPHONATE COMPOUNDS AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2018-06-21 US disclosed
US-20180170951-A1 AMIDE-LINKED EP4 AGONIST-BISPHOSPHONATE COMPOUNDS AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2018-06-21 US disclosed
US-9650414-B1 Dual-action EP4 agonist—bisphosphonate conjugates and uses thereof SIMON FRASER UNIVERSITY (CA) 2017-05-16 US disclosed
US-9650414-B1 Dual-action EP4 agonist—bisphosphonate conjugates and uses thereof SIMON FRASER UNIVERSITY (CA) 2017-05-16 US disclosed
US-20130157984-A1 PROSTAGLANDIN-BISPHOSPHONATE CONJUGATE COMPOUNDS, METHODS OF MAKING SAME, AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2013-06-20 US disclosed
US-20130157984-A1 PROSTAGLANDIN-BISPHOSPHONATE CONJUGATE COMPOUNDS, METHODS OF MAKING SAME, AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2013-06-20 US disclosed
WO-2011147034-A1 PROSTAGLANDIN-BISPHOSPHONATE CONJUGATE COMPOUNDS, METHODS OF MAKING SAME, AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2011-12-01 WO disclosed
EP-1513589-B1 1,5-DISUBSTITUTED PYRROLID-2-ONE DERIVATIVES FOR USE AS EP4 RECEPTOR AGONISTS IN THE TREATMENT OF EYE DISEASES SUCH AS GLAUCOMA MERCK FROSST CANADA LTD (CA) 2010-11-10 EP disclosed
US-20090258918-A1 EP4 receptor agonist, compositions and methods thereof BILLOT XAVIER 2009-10-15 US disclosed
US-20090258918-A1 EP4 receptor agonist, compositions and methods thereof BILLOT XAVIER 2009-10-15 US disclosed
US-20090258918-A1 EP4 receptor agonist, compositions and methods thereof BILLOT XAVIER 2009-10-15 US disclosed
US-20050239872-A1 1,5-distributed pyrrolid-2-one derivatives for use as ep4 receptor agonists in the teatment of eye diseases such as glaucoma MERCK FROSST CANADA LTD. (CA) 2005-10-27 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 (9 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-20050239872-A1 1,5-distributed pyrrolid-2-one derivatives for use as ep4 receptor agonists in the teatment of eye diseases such as glaucoma PTGER1, PTGER4, PTGER2 PTGER4 2/4885PTGER3 4/4885PTGER2 3/4885
US-20180170951-A1 AMIDE-LINKED EP4 AGONIST-BISPHOSPHONATE COMPOUNDS AND USES THEREOF PTGER4, ENPP2, PTGER3 PTGER4 1/4885PTGER3 3/4885PTGER2 5/4885
US-11312737-B2 Amide-linked EP4 agonist-bisphosphonate compounds and uses thereof PTGER4, ENPP2, GPR4 PTGER4 1/4885PTGER3 5/4885PTGER2 8/4885
US-10400000-B2 Amide-linked EP4 agonist-bisphosphonate compounds and uses thereof PTGER4, ENPP2, PTGER3 PTGER4 1/4885PTGER3 3/4885PTGER2 5/4885
US-20090258918-A1 EP4 receptor agonist, compositions and methods thereof PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGER3 3/4885PTGER2 4/4885
US-20130317013-A1 EP4 RECEPTOR AGONIST, COMPOSITIONS AND METHODS THEREOF PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGER3 3/4885PTGER2 4/4885
US-20130157984-A1 PROSTAGLANDIN-BISPHOSPHONATE CONJUGATE COMPOUNDS, METHODS OF MAKING SAME, AND USES THEREOF PTGES, PTGFR, PTGIS PTGER4 14/4885PTGER3 15/4885PTGER2 10/4885
US-20190345179-A1 AMIDE-LINKED EP4 AGONIST-BISPHOSPHONATE COMPOUNDS AND USES THEREOF PTGER4, ENPP2, GPR4 PTGER4 1/4885PTGER3 5/4885PTGER2 8/4885
US-20220242893-A1 AMIDE-LINKED CONJUGATE COMPOUNDS AND USES THEREOF AADAC, DNPEP, NAALAD2 PTGER4 3757/4885PTGER3 3169/4885PTGER2 3912/4885

“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.