SCHEMBL17834727

SCHEMBL17834727

C[C@@H](NC(=O)[C@H](Cc1ccc(-c2ncc(/C=C/c3cccc(F)c3)cn2)cc1)NC(=O)c1ccc(C(C)(C)C)s1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.37
ANPEP P15144 2/20 0.37
KIFC1 Q9BW19 4/20 0.36
CTSL P07711 1/20 0.36
PIN1 Q13526 1/20 0.35
MCL1 Q07820 1/20 0.35
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPN6 P29350 1/20 0.34
CDC25B P30305 1/20 0.34
USP30 Q70CQ3 1/20 0.34
KLKB1 P03952 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
SCHEMBL17834556 0.93 MME (0.36) MMEANPEPKIFC1CTSLMCL1
SCHEMBL17834555 0.92 CTSL (0.38) MMEANPEPKIFC1CTSLMCL1
SCHEMBL16306239 0.92 MME (0.42) MMEANPEPMCL1KLKB1
SCHEMBL17834777 0.91 KIFC1 (0.45) KIFC1CTSLMCL1
SCHEMBL22384491 0.91 CTSL (0.34) MMEKIFC1CTSLPIN1USP30
SCHEMBL17834845 0.91 KIFC1 (0.41) MMEANPEPKIFC1USP30
SCHEMBL17834725 0.91 NPC1 (0.39) MMEANPEPCTSLUSP30
SCHEMBL17834553 0.90 PSMB5 (0.35) MMEANPEPKIFC1CTSLPIN1
SCHEMBL17834541 0.90 GPR139 (0.41) MMEANPEPCTSLPTPN2PTPN1
SCHEMBL17834776 0.88 NPC1 (0.41) MMEANPEPKIFC1USP30

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 796/4885ANPEP 305/4885KIFC1 4738/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R MME 796/4885ANPEP 305/4885KIFC1 4738/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR MME 919/4885ANPEP 407/4885KIFC1 4749/4885

“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.