SCHEMBL17834928

SCHEMBL17834928

CCc1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(-c4ccc([C@H]5CC[C@H](CC)CC5)cc4)cn3)cc2)C(=O)O)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 7/20 0.38
▸ GABRA5 P31644 1/20 0.37
▸ ITGB1 P05556 2/20 0.36
▸ ITGA4 P13612 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ACE P12821 6/20 0.35
▸ CPA1 P15085 6/20 0.35
▸ ACE2 Q9BYF1 6/20 0.35
▸ DGAT1 O75907 2/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGAV P06756 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ ITGA5 P08648 1/20 0.35
▸ ITGB5 P18084 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ GPR132 Q9UNW8 1/20 0.35
▸ PDK1 Q15118 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ PDK3 Q15120 1/20 0.34

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
SCHEMBL17834635 0.91 ITGB1 (0.40) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17834669 0.89 DGAT1 (0.41) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17834643 0.89 ITGB1 (0.40) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17834638 0.89 ITGB1 (0.40) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17834921 0.89 MME (0.37) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17834790 0.89 ITGB1 (0.37) MMEGABRA5ITGB1ITGA4ACE
SCHEMBL17834624 0.88 L3MBTL1 (0.41) MMEITGB1ITGA4PTPN1L3MBTL1
SCHEMBL17995135 0.88 CA2 (0.46) ITGB1ITGA4PTPN1DGAT1ROCK2
SCHEMBL19481404 0.88 DGAT1 (0.45) MMEGABRA5ITGB1ITGA4DGAT1
SCHEMBL17834647 0.87 ITGB1 (0.40) MMEITGB1ITGA4PTPN1L3MBTL1

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 7 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-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-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 MME 796/4885GABRA5 754/4885ITGB1 3589/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R MME 796/4885GABRA5 754/4885ITGB1 3589/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR MME 919/4885GABRA5 694/4885ITGB1 3369/4885

“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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