SCHEMBL16294766

SCHEMBL16294766

CCCCCCCOc1ccc(-c2cnc(-c3ccc(CC(NC(=O)OCc4ccccc4)C(=O)N4CC(C(=O)OC(C)(C)C)C4)cc3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH2 P25021 3/20 0.48
▸ HRH1 P35367 3/20 0.48
▸ ITGB3 P05106 10/20 0.46
▸ ITGA2B P08514 10/20 0.46
▸ ITGAV P06756 1/20 0.46
▸ P2RX7 Q99572 7/20 0.45

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
SCHEMBL16305994 1.00 HRH2 (0.48) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16295824 0.93 ITGB3 (0.49) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16295823 0.93 ITGB3 (0.49) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16343092 0.92 ITGB3 (0.50) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16295738 0.92 ITGB3 (0.50) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL19485536 0.89 HRH2 (0.42) HRH2HRH1
SCHEMBL16305642 0.88 ITGB3 (0.47) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL22384305 0.88 ITGB3 (0.47) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16343396 0.88 ITGB3 (0.48) HRH2HRH1ITGB3ITGA2BITGAV
SCHEMBL16295969 0.88 ITGB3 (0.48) HRH2HRH1ITGB3ITGA2BITGAV

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 16 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
EP-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — EP disclosed
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP disclosed
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — 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
US-9598430-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-03-21 — — US disclosed
US-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-08-11 — — US disclosed
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-07-28 — — US disclosed
EP-3008056-A1 NOVEL GLP-1 RECEPTOR MODULATORS Receptos, Inc. (US) 2016-04-20 — — EP disclosed
US-9260427-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2016-02-16 — — US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — US disclosed
WO-2014201172-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS, INC. (US) 2014-12-18 — — 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 (7 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 HRH2 530/4885HRH1 485/4885ITGB3 4025/4885
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HRH2 530/4885HRH1 485/4885ITGB3 4025/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HRH2 530/4885HRH1 485/4885ITGB3 4025/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HRH2 530/4885HRH1 485/4885ITGB3 4025/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR HRH2 469/4885HRH1 426/4885ITGB3 3678/4885
US-10259823-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR HRH2 469/4885HRH1 426/4885ITGB3 3678/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HRH2 530/4885HRH1 485/4885ITGB3 4025/4885

“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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