SCHEMBL4085052

SCHEMBL4085052

Cc1sc(C)c(C(=O)NC2(c3ccc(C(=O)O)cc3)CC2)c1Cc1ccc(C(F)(F)F)cc1.[NaH]

nearest known ligand 0.98

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 20/20 0.98
PTGER2 P43116 5/20 0.98
PTGDR Q13258 2/20 0.49
TBXA2R P21731 1/20 0.49
PTGER1 P34995 1/20 0.49
PTGFR P43088 1/20 0.49
PTGER3 P43115 1/20 0.49

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
SCHEMBL2351863 0.99 PTGER4 (1.00) PTGER4PTGER2PTGDRTBXA2RPTGER1
Diethylamine SCHEMBL3019803 0.95 PTGER4 (0.91) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL13210500 0.91 PTGER4 (0.86) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL4085048 0.90 PTGER4 (0.83) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL4090366 0.90 PTGER4 (0.83) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL4100421 0.89 PTGER4 (0.98) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL13229809 0.88 PTGER4 (0.80) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL2352729 0.88 PTGER4 (1.00) PTGER4PTGER2PTGDRTBXA2RPTGER1
Formic Acid SCHEMBL28263353 0.87 PTGER4 (0.78) PTGER4PTGER2PTGDRTBXA2RPTGER1
SCHEMBL4085074 0.86 PTGER4 (0.77) PTGER4PTGER2PTGDRTBXA2RPTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8969394-B2 Thiophenecarboxamide derivatives as EP4 receptor ligands MERCK FROSST CANADA LTD. (CA) 2015-03-03 US disclosed
US-20090247596-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS MERCK CANADA INC. (CA) 2009-10-01 US disclosed
EP-2054401-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS Merck Frosst Canada Ltd. (CA) 2009-05-06 EP disclosed
WO-2008017164-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS MERCK FROSST CANADA LTD. (CA) 2008-02-14 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-20090247596-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS PTGER4, PTGER1, PTGER2 PTGER4 1/4885PTGER2 3/4885PTGDR 11/4885

“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.