SCHEMBL4018036

SCHEMBL4018036

C[C@H](NC(=O)c1cc(Cl)ccc1OCc1ccccc1F)c1ccc(C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 16/20 0.63
PTGER2 P43116 5/20 0.63
MRGPRX4 Q96LA9 1/20 0.50
LMNA P02545 1/20 0.48
PTGER1 P34995 2/20 0.48
PTGDR Q13258 1/20 0.47

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
SCHEMBL5505531 0.92 PTGER4 (0.65) PTGER4PTGER2MRGPRX4PTGER1PTGDR
SCHEMBL691884 0.92 PTGER4 (0.65) PTGER4PTGER2MRGPRX4PTGER1PTGDR
SCHEMBL4013928 0.92 PTGER4 (0.52) PTGER4PTGER2LMNAPTGER1
SCHEMBL691790 0.91 PTGER4 (0.66) PTGER4PTGER2LMNAPTGDR
SCHEMBL691179 0.91 PTGER4 (0.68) PTGER4PTGER2MRGPRX4PTGER1PTGDR
SCHEMBL26914669 0.91 PTGER4 (0.68) PTGER4PTGER2MRGPRX4PTGER1PTGDR
SCHEMBL691142 0.90 PTGER4 (0.63) PTGER4PTGER2MRGPRX4PTGER1PTGDR
SCHEMBL4017242 0.90 PTGER4 (0.67) PTGER4PTGER2PTGER1
SCHEMBL690929 0.89 PTGER4 (0.67) PTGER4PTGER2PTGDR
SCHEMBL8271818 0.89 PTGER4 (0.61) PTGER4PTGER2PTGER1PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756043-B1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS RAQUALIA PHARMA INC (JP) 2009-07-01 EP disclosed
EP-1756043-B1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS RAQUALIA PHARMA INC (JP) 2009-07-01 EP disclosed
WO-2005102389-A9 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2009-04-30 WO disclosed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US disclosed
EP-1740211-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-01-10 EP disclosed
US-20050250818-A1 Ortho substituted aryl or heteroaryl amide compounds PFIZER INC 2005-11-10 US disclosed
WO-2005102389-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-03 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-20050250818-A1 Ortho substituted aryl or heteroaryl amide compounds OPRL1, PTGER1, OPRM1 PTGER4 19/4885PTGER2 6/4885MRGPRX4 105/4885
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PTGER4, PTGER2, OPRL1 PTGER4 1/4885PTGER2 2/4885MRGPRX4 89/4885

“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.