SCHEMBL19485542

SCHEMBL19485542

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

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 7/20 0.52
▸ ITGA2B P08514 7/20 0.52
▸ KLKB1 P03952 3/20 0.47
▸ PLG P00747 1/20 0.47
▸ PPARG P37231 3/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ ITGB1 P05556 2/20 0.44
▸ ITGA4 P13612 2/20 0.44
▸ DHFR P00374 2/20 0.44
▸ FPGS Q05932 2/20 0.44
▸ SUCNR1 Q9BXA5 2/20 0.41

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
SCHEMBL16305669 0.98 ITGB3 (0.53) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305804 0.98 ITGB3 (0.53) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16306212 0.96 ITGB3 (0.51) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305802 0.96 ITGB3 (0.51) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16306205 0.95 PPARG (0.47) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305683 0.94 PPARG (0.47) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305513 0.93 PPARG (0.45) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305796 0.93 ITGB3 (0.50) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL16305793 0.93 ITGB3 (0.50) ITGB3ITGA2BKLKB1PLGPPARG
SCHEMBL20426086 0.93 PPARG (0.45) ITGB3ITGA2BKLKB1PLGPPARG

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-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ITGB3 4025/4885ITGA2B 4142/4885KLKB1 2855/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ITGB3 4025/4885ITGA2B 4142/4885KLKB1 2855/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ITGB3 3678/4885ITGA2B 4134/4885KLKB1 2865/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ITGB3 3678/4885ITGA2B 4134/4885KLKB1 2865/4885

“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