SCHEMBL17968902

SCHEMBL17968902

CC(C)(C)c1ccc(C(=O)NC(Cc2ccc(-c3ncc(Br)cn3)cc2)C(=O)OC(=O)[C@@H]2CCCN2)s1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.38
▸ CTSC P53634 6/20 0.33
▸ CCNE2 O96020 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ PRCP P42785 1/20 0.32
▸ CTSK P43235 2/20 0.32
▸ KCNH2 Q12809 2/20 0.32
▸ MME P08473 1/20 0.32
▸ SCN3A Q9NY46 3/20 0.31
▸ SCN9A Q15858 2/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ KIFC1 Q9BW19 1/20 0.31
▸ GHSR Q92847 1/20 0.31
▸ SCN5A Q14524 1/20 0.30

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
SCHEMBL17968929 0.87 DPP4 (0.34) DPP4CTSC
SCHEMBL17459554 0.87 KIFC1 (0.37) CTSCCCNE2CCNE1CDK2CTSK
SCHEMBL17459559 0.86 KIF11 (0.32) CTSCCDK2PRCPKIF11KIFC1
SCHEMBL17459590 0.84 ITGB1 (0.34) PRCP
SCHEMBL17459589 0.84 ITGB1 (0.34) PRCP
SCHEMBL28532732 0.83 ITGB1 (0.33) —
SCHEMBL28532154 0.83 CACNA1B (0.33) PRCP
SCHEMBL17825497 0.81 MAPT (0.43) —
SCHEMBL17825520 0.81 MAPT (0.43) —
SCHEMBL15037038 0.81 MAPT (0.43) —

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 5 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
US-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-08-11 — — 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 (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 DPP4 54/4885CTSC 75/4885CCNE2 3276/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R DPP4 54/4885CTSC 75/4885CCNE2 3276/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR DPP4 51/4885CTSC 81/4885CCNE2 2883/4885

“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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