SCHEMBL16305983

SCHEMBL16305983

CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(C(C)(C)C)cc4)C(=O)N[C@@H](CO)C(=O)O)cc3)nc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ ITGB1 P05556 3/20 0.47
▸ ITGA4 P13612 3/20 0.47
▸ ITGB3 P05106 5/20 0.47
▸ ITGA2B P08514 5/20 0.47
▸ KLKB1 P03952 1/20 0.46
▸ PLG P00747 1/20 0.45
▸ CBX4 O00257 2/20 0.43
▸ CBX7 O95931 2/20 0.43
▸ CDYL2 Q8N8U2 2/20 0.43
▸ CBX8 Q9HC52 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ RARB P10826 3/20 0.42

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
SCHEMBL19544766 1.00 PPARG (0.47) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16306129 1.00 PPARG (0.47) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16305929 0.96 ITGB3 (0.45) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16380214 0.94 PPARG (0.48) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16306044 0.94 PPARG (0.48) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16380212 0.94 PPARG (0.48) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16305683 0.94 PPARG (0.47) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16305682 0.94 ITGB3 (0.53) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16306205 0.94 PPARG (0.47) PPARGPPARAITGB1ITGA4ITGB3
SCHEMBL16305796 0.93 ITGB3 (0.50) PPARGPPARAITGB1ITGA4ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10259823-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2019-04-16 — — US disclosed
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 — — US disclosed
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 — — US disclosed
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2017-11-02 — — US disclosed
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 — — US disclosed
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 — — US disclosed
US-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-08-11 — — US disclosed
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-07-28 — — US disclosed
WO-2016094729-A1 GLP-1 RECEPTOR MODULATORS CELGENE INTERNATIONAL II SARL (CH) 2016-06-16 — — WO disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — US disclosed
WO-2014201172-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS, INC. (US) 2014-12-18 — — 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 (6 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-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R PPARG 317/4885PPARA 491/4885ITGB1 3589/4885
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R PPARG 317/4885PPARA 491/4885ITGB1 3589/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R PPARG 317/4885PPARA 491/4885ITGB1 3589/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR PPARG 263/4885PPARA 417/4885ITGB1 3369/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR PPARG 263/4885PPARA 417/4885ITGB1 3369/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R PPARG 317/4885PPARA 491/4885ITGB1 3589/4885

“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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