SCHEMBL1888760

SCHEMBL1888760

COc1ccc(-c2ccc(-c3cccc(C(F)(F)F)c3)c(C(F)F)c2)c(CCC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 4/20 0.45
▸ AKR1C2 P52895 4/20 0.45
▸ PTGDR2 Q9Y5Y4 2/20 0.44
▸ FFAR1 O14842 3/20 0.43
▸ FFAR4 Q5NUL3 2/20 0.43
▸ MAOA P21397 2/20 0.43
▸ PLAU P00749 2/20 0.42
▸ PLAT P00750 2/20 0.42
▸ PLG P00747 1/20 0.42
▸ MTNR1A P48039 1/20 0.42
▸ MTNR1B P49286 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ GCGR P47871 1/20 0.41
▸ CTSA P10619 1/20 0.41
▸ PPARD Q03181 2/20 0.41
▸ PTGER4 P35408 1/20 0.40
▸ PTGER3 P43115 1/20 0.40
▸ AKR1C4 P17516 1/20 0.40
▸ AKR1C1 Q04828 1/20 0.40

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
SCHEMBL1906562 0.89 MTNR1A (0.41) AKR1C3AKR1C2PTGDR2MAOAPLAU
SCHEMBL1889424 0.87 PTGDR2 (0.46) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL1895197 0.87 AKR1C3 (0.44) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL1894408 0.87 FFAR1 (0.50) FFAR1FFAR4MTNR1AMTNR1BPOLB
SCHEMBL1809637 0.87 SLC1A3 (0.45) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL1890265 0.86 MME (0.42) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL35843126 0.86 MME (0.42) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL19209470 0.84 XDH (0.51) AKR1C3AKR1C2PTGDR2FFAR1FFAR4
SCHEMBL1804925 0.83 CYP11B2 (0.45) FFAR1FFAR4MTNR1AMTNR1BPOLB
SCHEMBL35843124 0.77 KDM4E (0.43) AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160184274-A1 Methods for inhibiting mesenchymal phenotype after epithelial-to-mesenchymal transition UNIVERSITAT DE VALENCIA (ES) 2016-06-30 — — US claimed
EP-2496544-B1 GPBP INHIBITION USING Q2 PEPTIDOMIMETICS FIBROSTATIN S L (SE) 2014-08-20 — — EP claimed
US-8586776-B2 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2013-11-19 — — US claimed
US-20110105545-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2011-05-05 — — US claimed
US-10544083-B2 GPBP inhibition using Q2 peptidomimetics UNIVERSITAT DE VALÈNCIA (ES) 2020-01-28 — — US disclosed
US-10544083-B2 GPBP inhibition using Q2 peptidomimetics UNIVERSITAT DE VALÈNCIA (ES) 2020-01-28 — — US disclosed
EP-3049815-B1 GOODPASTURE ANTIGEN BINDING PROTEIN DETECTION AND INHIBITION AND ITS USE IN DIABETES FIBROSTATIN SL (ES) 2019-03-13 — — EP disclosed
US-20180179139-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2018-06-28 — — US disclosed
US-20180179139-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2018-06-28 — — US disclosed
US-20170204197-A1 Goodpasture Antigen Binding Protein Detection and Inhibition and its Use in Diabetes FIBROSTATIN S L (ES) 2017-07-20 — — US disclosed
US-20160184274-A1 Methods for inhibiting mesenchymal phenotype after epithelial-to-mesenchymal transition UNIVERSITAT DE VALENCIA (ES) 2016-06-30 — — US disclosed
US-20160083327-A1 GPBP inhibition using Q2 peptidomimetics JUAN SAUS (ES) 2016-03-24 — — US disclosed
EP-2496544-B1 GPBP INHIBITION USING Q2 PEPTIDOMIMETICS FIBROSTATIN S L (SE) 2014-08-20 — — EP disclosed
US-20140080852-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2014-03-20 — — US disclosed
US-20140080852-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2014-03-20 — — US disclosed
WO-2014006020-A1 GPBP-1 INHIBITION AND ITS THERAPEUTIC USE FIBROSTATIN, S.L. (ES) 2014-01-09 — — WO disclosed
US-8586776-B2 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2013-11-19 — — US disclosed
WO-2011054530-A1 GPBP INHIBITION USING Q2 PEPTIDOMIMETICS FIBROSTATIN, S.L. (ES) 2011-05-12 — — WO disclosed
US-20110105545-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2011-05-05 — — US disclosed
US-20110105545-A1 GPBP inhibition using Q2 peptidomimetics FIBROSTATIN, S.L. (ES) 2011-05-05 — — 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 (7 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-20170204197-A1 Goodpasture Antigen Binding Protein Detection and Inhibition and its Use in Diabetes CD2BP2, SAP30BP, LY96 AKR1C3 4204/4885AKR1C2 3470/4885PTGDR2 723/4885
US-10544083-B2 GPBP inhibition using Q2 peptidomimetics HSP90B1, ERP44, HSPA5 AKR1C3 3765/4885AKR1C2 4103/4885PTGDR2 1766/4885
US-20140080852-A1 GPBP inhibition using Q2 peptidomimetics HSP90B1, ERP44, HSPA5 AKR1C3 3765/4885AKR1C2 4103/4885PTGDR2 1766/4885
US-20110105545-A1 GPBP inhibition using Q2 peptidomimetics HSP90B1, ERP44, HSPA5 AKR1C3 3765/4885AKR1C2 4103/4885PTGDR2 1766/4885
US-20160184274-A1 Methods for inhibiting mesenchymal phenotype after epithelial-to-mesenchymal transition VIM, EPCAM, CDH1 AKR1C3 4510/4885AKR1C2 4298/4885PTGDR2 2153/4885
US-20180179139-A1 GPBP inhibition using Q2 peptidomimetics HSP90B1, ERP44, HSPA5 AKR1C3 3765/4885AKR1C2 4103/4885PTGDR2 1766/4885
US-20160083327-A1 GPBP inhibition using Q2 peptidomimetics HSP90B1, ERP44, HSPA5 AKR1C3 3765/4885AKR1C2 4103/4885PTGDR2 1766/4885

“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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