SCHEMBL15091963

SCHEMBL15091963

CC(C)(C)c1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(C#N)cn3)cc2)C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.47
▸ CTSB P07858 2/20 0.47
▸ CTSS P25774 2/20 0.47
▸ CTSK P43235 2/20 0.47
▸ PTPN1 P18031 3/20 0.45
▸ XDH P47989 1/20 0.45
▸ GPR132 Q9UNW8 2/20 0.45
▸ CTSL P07711 3/20 0.43
▸ ITGB1 P05556 1/20 0.43
▸ ITGA4 P13612 1/20 0.43
▸ ITGB7 P26010 1/20 0.43
▸ MME P08473 2/20 0.42
▸ ACE P12821 2/20 0.42
▸ ACE2 Q9BYF1 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CPA1 P15085 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ KDM4A O75164 1/20 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
SCHEMBL15091968 1.00 EPHX2 (0.47) EPHX2CTSBCTSSCTSKPTPN1
SCHEMBL22384157 0.88 EPHX2 (0.44) EPHX2CTSBCTSSCTSKPTPN1
SCHEMBL15037131 0.88 EPHX2 (0.44) EPHX2CTSBCTSSCTSKPTPN1
SCHEMBL22449277 0.88 MME (0.49) CTSBCTSSCTSKPTPN1GPR132
SCHEMBL15037189 0.88 MME (0.49) CTSBCTSSCTSKPTPN1GPR132
SCHEMBL15019743 0.87 EPHX2 (0.62) EPHX2CTSBCTSSCTSKPTPN1
SCHEMBL22448948 0.86 MME (0.53) CTSBCTSSCTSKPTPN1GPR132
SCHEMBL15018822 0.86 PTPN1 (0.47) CTSBCTSSCTSKPTPN1GPR132
SCHEMBL15018825 0.86 PTPN1 (0.47) CTSBCTSSCTSKPTPN1GPR132
SCHEMBL22449043 0.86 MME (0.53) CTSBCTSSCTSKPTPN1GPR132

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 17 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-2791112-B1 CARBOXYLIC ACID DERIVATIVES COMPRISING FOUR CYCLES ACTING AS GLP-1 RECEPTOR MODULATORS FOR THERAPY OF DISEASES SUCH AS DIABETES CELGENE INT II SÀRL (CH) 2020-09-23 — — 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-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-9598430-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-03-21 — — 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
US-9260427-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2016-02-16 — — US disclosed
US-9187522-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2015-11-17 — — US disclosed
US-20150038416-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-02-05 — — US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — US disclosed
US-8778923-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2014-07-15 — — US disclosed
US-20130178420-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS, INC. (US) 2013-07-11 — — 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 (9 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 EPHX2 4296/4885CTSB 1692/4885CTSS 3233/4885
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4296/4885CTSB 1692/4885CTSS 3233/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4296/4885CTSB 1692/4885CTSS 3233/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4296/4885CTSB 1692/4885CTSS 3233/4885
US-20130178420-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4053/4885CTSB 1572/4885CTSS 2806/4885
US-20150038416-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4053/4885CTSB 1572/4885CTSS 2806/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR EPHX2 4326/4885CTSB 1992/4885CTSS 3308/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR EPHX2 4326/4885CTSB 1992/4885CTSS 3308/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R EPHX2 4296/4885CTSB 1692/4885CTSS 3233/4885

“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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