SCHEMBL17834823

SCHEMBL17834823

CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(C(C)C)cc4)C(=O)N4CCC[C@H]4C(=O)O)cc3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ACE P12821 10/20 0.47
▸ ACE2 Q9BYF1 7/20 0.47
▸ TSHR P16473 1/20 0.44
▸ PPARG P37231 2/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ NPSR1 Q6W5P4 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
SCHEMBL17834829 0.94 L3MBTL1 (0.49) L3MBTL1ACEACE2TSHRPPARG
SCHEMBL19485713 0.94 L3MBTL1 (0.51) L3MBTL1ACEACE2TSHR
SCHEMBL17834828 0.93 L3MBTL1 (0.49) L3MBTL1ACEACE2TSHR
SCHEMBL17834851 0.93 L3MBTL1 (0.49) L3MBTL1ACEACE2TSHR
SCHEMBL20426117 0.92 L3MBTL1 (0.48) L3MBTL1ACEACE2TSHR
SCHEMBL16305979 0.92 L3MBTL1 (0.48) L3MBTL1ACEACE2TSHR
SCHEMBL17834426 0.90 L3MBTL1 (0.47) L3MBTL1ACEACE2TSHR
SCHEMBL17834432 0.90 L3MBTL1 (0.46) L3MBTL1ACEACE2TSHR
SCHEMBL17834849 0.89 L3MBTL1 (0.49) L3MBTL1ACEACE2TSHR
SCHEMBL19807162 0.89 HRH3 (0.41) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 — — 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 (2 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 L3MBTL1 771/4885ACE 3137/4885ACE2 3162/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR L3MBTL1 579/4885ACE 2924/4885ACE2 3115/4885

“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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