SCHEMBL16306148

SCHEMBL16306148

CC(C)(C)c1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(-c4ccc(OCC5CCCC5)cc4)cn3)cc2)C(=O)N2CC(C(=O)O)C2)s1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.36
▸ MAPK11 Q15759 2/20 0.35
▸ MAPK14 Q16539 2/20 0.35
▸ PRCP P42785 1/20 0.34
▸ ACACB O00763 5/20 0.34
▸ ITGB1 P05556 2/20 0.34
▸ ITGA5 P08648 1/20 0.34
▸ ACACA Q13085 1/20 0.34
▸ HRH2 P25021 1/20 0.34
▸ HRH1 P35367 1/20 0.34
▸ LPAR3 Q9UBY5 1/20 0.34
▸ PARP15 Q460N3 1/20 0.34
▸ PARP10 Q53GL7 1/20 0.34
▸ ITGA4 P13612 2/20 0.34
▸ ITGB7 P26010 2/20 0.34
▸ GLP1R P43220 1/20 0.34
▸ TPH1 P17752 1/20 0.33

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
SCHEMBL16305699 0.97 ACACB (0.36) ACACBITGB1ITGA5HRH2HRH1
SCHEMBL16306127 0.94 ITGB1 (0.38) SRCMAPK11MAPK14PRCPACACB
SCHEMBL16306195 0.94 ITGB1 (0.38) SRCMAPK11MAPK14PRCPACACB
SCHEMBL16306128 0.91 ITGB1 (0.39) SRCPRCPACACBITGB1ITGA5
SCHEMBL16306000 0.91 ITGB1 (0.39) SRCPRCPACACBITGB1ITGA5
SCHEMBL16306134 0.90 PYGL (0.34) PRCPITGB1ITGA5HRH2HRH1
SCHEMBL16305996 0.90 S1PR1 (0.40) ITGB1ITGA5HRH2HRH1ITGA4
SCHEMBL16305702 0.90 ITGA4 (0.39) ITGB1ITGA4ITGB7
SCHEMBL16305995 0.89 S1PR1 (0.37) ACACBITGB1ITGA5ACACAHRH2
SCHEMBL16306001 0.89 ITGB1 (0.36) PRCPACACBITGB1ITGA5HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — EP disclosed
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP disclosed
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-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2018-01-25 — — 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 (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-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R SRC 2971/4885MAPK11 1467/4885MAPK14 2013/4885
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R SRC 2971/4885MAPK11 1467/4885MAPK14 2013/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R SRC 2971/4885MAPK11 1467/4885MAPK14 2013/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R SRC 2971/4885MAPK11 1467/4885MAPK14 2013/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR SRC 2652/4885MAPK11 1484/4885MAPK14 2127/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR SRC 2652/4885MAPK11 1484/4885MAPK14 2127/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R SRC 2971/4885MAPK11 1467/4885MAPK14 2013/4885

“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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