SCHEMBL5221601

SCHEMBL5221601

O=C(O)CCCSCCN1C(=O)CCC1CCC(O)c1cccc(Oc2cccc(F)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.59
PTGER3 P43115 2/20 0.59
PTGER2 P43116 2/20 0.51
PTGER1 P34995 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
SCHEMBL5216634 1.00 PTGER4 (0.59) PTGER4PTGER3PTGER2PTGER1
SCHEMBL14463794 0.92 PTGER4 (0.51) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5734360 0.85 PTGER4 (0.69) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5734366 0.85 PTGER4 (0.69) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5734355 0.85 PTGER4 (0.69) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5214074 0.84 PTGER4 (0.68) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5214080 0.84 PTGER4 (0.68) PTGER4PTGER3PTGER2PTGER1
SCHEMBL14261763 0.83 PTGER4 (0.50) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5216126 0.79 PTGER4 (0.76) PTGER4PTGER3PTGER2PTGER1
SCHEMBL5216140 0.79 PTGER4 (0.76) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408961-B1 2 PYRROLIDONE DERIVATIVES AS PROSTANOID AGONISTS HOFFMANN LA ROCHE (CH) 2007-07-11 EP claimed
US-6849657-B2 2-pyrrolidone derivatives as prostanoid agonists SYNTEX (U.S.A.) LLC (US) 2005-02-01 US claimed
EP-1408961-A1 2 PYRROLIDONE DERIVATIVES AS PROSTANOID AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-21 EP claimed
US-20030064964-A1 2-pyrrolidone derivatives as prostanoid agonists ONO PHARMACEUTICAL CO., LTD. (JP) 2003-04-03 US claimed
WO-2003007941-A1 2 PYRROLIDONE DERIVATIVES AS PROSTANOID AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-01-30 WO claimed
EP-1408961-B1 2 PYRROLIDONE DERIVATIVES AS PROSTANOID AGONISTS HOFFMANN LA ROCHE (CH) 2007-07-11 EP disclosed
US-6849657-B2 2-pyrrolidone derivatives as prostanoid agonists SYNTEX (U.S.A.) LLC (US) 2005-02-01 US disclosed
US-20030064964-A1 2-pyrrolidone derivatives as prostanoid agonists ONO PHARMACEUTICAL CO., LTD. (JP) 2003-04-03 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 (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-20030064964-A1 2-pyrrolidone derivatives as prostanoid agonists PTGER1, PTGER4, PTGIR PTGER4 2/4885PTGER3 7/4885PTGER2 4/4885

“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.