SCHEMBL4094060

SCHEMBL4094060

CC(C)OC(=O)c1ccc(CCN2C(=O)OCC[C@@H]2C=C[C@@H](O)C(F)(F)c2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 15/20 0.40
▸ PTGER2 P43116 12/20 0.40
▸ PTGER3 P43115 5/20 0.39
▸ TBXA2R P21731 1/20 0.38

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
SCHEMBL4303788 1.00 PTGER4 (0.40) PTGER4PTGER2PTGER3TBXA2R
SCHEMBL4094057 1.00 PTGER4 (0.40) PTGER4PTGER2PTGER3TBXA2R
SCHEMBL4084171 0.93 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4299911 0.93 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4084166 0.93 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4096131 0.89 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4096133 0.89 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4305387 0.89 PTGER4 (0.40) PTGER4PTGER2PTGER3
SCHEMBL4296332 0.89 PTGER4 (0.49) PTGER4PTGER2PTGER3TBXA2R
SCHEMBL4090911 0.89 PTGER4 (0.49) PTGER4PTGER2PTGER3TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270395-A1 EP4 Receptor Agonist, Compositions and Methods Thereof MERCK & CO., INC. 2009-10-29 — — US claimed
US-20090270395-A1 EP4 Receptor Agonist, Compositions and Methods Thereof MERCK & CO., INC. 2009-10-29 — — US disclosed
EP-1912957-A4 EP4 RECEPTOR AGONIST, COMPOSITIONS AND METHODS THEREOF MERCK FROSST CANADA LTD (CA) 2009-05-13 — — EP disclosed
EP-1912957-A1 EP4 RECEPTOR AGONIST, COMPOSITIONS AND METHODS THEREOF Merck Frosst Canada Ltd. (CA) 2008-04-23 — — EP disclosed
WO-2007014462-A1 EP4 RECEPTOR AGONIST, COMPOSITIONS AND METHODS THEREOF MERCK FROSST CANADA LTD. (CA) 2007-02-08 — — 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 (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-20090270395-A1 EP4 Receptor Agonist, Compositions and Methods Thereof PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGER2 4/4885PTGER3 3/4885

“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.

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