SCHEMBL17834610

SCHEMBL17834610

CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(CC(C)C)s4)C(=O)N4CCC[C@H]4C(=O)O)cc3)nc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 10/20 0.44
▸ ACE2 Q9BYF1 9/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MME P08473 1/20 0.39
▸ MMEL1 Q495T6 1/20 0.39
▸ PRSS1 P07477 1/20 0.38
▸ TMPRSS15 P98073 1/20 0.38
▸ GYS1 P13807 1/20 0.38

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
SCHEMBL17834850 0.95 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHRGYS1
SCHEMBL17834603 0.94 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHRGYS1
SCHEMBL15037156 0.90 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHR
SCHEMBL16295171 0.90 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHR
SCHEMBL19465510 0.90 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHR
SCHEMBL16342948 0.90 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHR
SCHEMBL15037148 0.90 L3MBTL1 (0.44) ACEACE2L3MBTL1TSHR
SCHEMBL17834829 0.90 L3MBTL1 (0.49) ACEACE2L3MBTL1TSHRNPSR1
SCHEMBL16380213 0.88 L3MBTL1 (0.42) ACEACE2L3MBTL1TSHR
SCHEMBL19485609 0.87 S1PR5 (0.38) L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP 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-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
WO-2016094729-A1 GLP-1 RECEPTOR MODULATORS CELGENE INTERNATIONAL II SARL (CH) 2016-06-16 — — 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 (3 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 ACE 3137/4885ACE2 3162/4885L3MBTL1 771/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ACE 3137/4885ACE2 3162/4885L3MBTL1 771/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ACE 2924/4885ACE2 3115/4885L3MBTL1 579/4885

“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.

Send feedback