SCHEMBL17834762

SCHEMBL17834762

C[C@@H](NC(=O)[C@H](Cc1ccc(-c2ncc(/C=C/c3ccc(Cl)cc3)cn2)cc1)NC(=O)c1ccc(C(C)(C)C)s1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.38
PPARG P37231 2/20 0.38
MME P08473 3/20 0.37
ANPEP P15144 2/20 0.37
MCL1 Q07820 1/20 0.35
CA2 P00918 1/20 0.35
NOS2 P35228 1/20 0.34
CTSL P07711 1/20 0.34
EED O75530 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
SCHEMBL17834890 0.93 MME (0.37) MMEANPEPEED
SCHEMBL16305890 0.93 MME (0.37) PPARGMMEANPEPMCL1EED
SCHEMBL16305891 0.93 MME (0.37) MMEANPEPEED
SCHEMBL16306239 0.93 MME (0.42) MMEANPEPMCL1EED
SCHEMBL17834725 0.92 NPC1 (0.39) MMEANPEPCA2NOS2CTSL
SCHEMBL16306249 0.92 MME (0.41) MMEANPEPMCL1CA2
SCHEMBL17834893 0.92 MME (0.41) MMEANPEPMCL1CA2
SCHEMBL17834539 0.91 MME (0.36) MMEANPEPEED
SCHEMBL17834758 0.91 MCL1 (0.40) PPARGMMEANPEPMCL1NOS2
SCHEMBL22384455 0.91 CDK2 (0.37) CDK2PPARGNOS2CTSLEED

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 CDK2 2609/4885PPARG 317/4885MME 796/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R CDK2 2609/4885PPARG 317/4885MME 796/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR CDK2 2270/4885PPARG 263/4885MME 919/4885

“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.