SCHEMBL17825546

SCHEMBL17825546

CCCC1CCC(C2CCN(c3cnc(-c4ccc(C[C@H](NC(=O)OCc5ccccc5)C(=O)N5CC(C(=O)OC)C5)cc4)nc3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 2/20 0.40
▸ ITGB3 P05106 3/20 0.39
▸ ITGA2B P08514 3/20 0.39
▸ P2RX7 Q99572 7/20 0.39
▸ ITGAV P06756 1/20 0.39
▸ CTSL P07711 2/20 0.39
▸ CTSB P07858 2/20 0.39
▸ CTSK P43235 2/20 0.39
▸ ITGA4 P13612 1/20 0.38
▸ ITGB7 P26010 1/20 0.38
▸ BCHE P06276 3/20 0.38
▸ ACHE P22303 3/20 0.38
▸ CACNA1F O60840 1/20 0.38
▸ CACNA1D Q01668 1/20 0.38
▸ CACNA1S Q13698 1/20 0.38
▸ CACNA1C Q13936 1/20 0.38
▸ YAP1 P46937 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
SCHEMBL17968959 1.00 FPR2 (0.40) FPR2ITGB3ITGA2BP2RX7ITGAV
SCHEMBL17968958 1.00 FPR2 (0.40) FPR2ITGB3ITGA2BP2RX7ITGAV
SCHEMBL17968852 0.95 ITGB3 (0.40) FPR2ITGB3ITGA2BP2RX7ITGAV
SCHEMBL17968853 0.95 ITGB3 (0.40) FPR2ITGB3ITGA2BP2RX7ITGAV
SCHEMBL17968854 0.95 ITGB3 (0.40) FPR2ITGB3ITGA2BP2RX7ITGAV
SCHEMBL17968911 0.84 DPP4 (0.36) —
SCHEMBL22384247 0.84 DPP4 (0.36) —
SCHEMBL17968910 0.84 DPP4 (0.36) —
SCHEMBL17968912 0.84 DPP4 (0.36) —
SCHEMBL17459532 0.82 P2RX7 (0.40) ITGB3ITGA2BP2RX7ITGAVYAP1

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
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
EP-3230276-A1 GLP-1 RECEPTOR MODULATORS Celgene International II Sarl (CH) 2017-10-18 — — EP 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 FPR2 492/4885ITGB3 4025/4885ITGA2B 4142/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R FPR2 492/4885ITGB3 4025/4885ITGA2B 4142/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR FPR2 499/4885ITGB3 3678/4885ITGA2B 4134/4885

“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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