SCHEMBL17834409

SCHEMBL17834409

CC(C)(C)OC(=O)C1CN(C(=O)[C@H](Cc2ccc(-c3ncc(-c4ccc(O)cc4F)cn3)cc2)NC(=O)c2ccc(C(C)(C)C)s2)C1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.33
ACE P12821 1/20 0.32
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
HPGDS O60760 1/20 0.32
FEN1 P39748 4/20 0.31
ALOX5AP P20292 3/20 0.31
DPP4 P27487 1/20 0.31
ROCK2 O75116 2/20 0.31
HSD11B1 P28845 1/20 0.31
HRH2 P25021 1/20 0.30
HRH1 P35367 1/20 0.30
PABPC1 P11940 1/20 0.30
SRC P12931 1/20 0.30
KMT2A Q03164 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
SCHEMBL22384132 1.00 ACACB (0.33) ACACBACEITGB3ITGA2BHPGDS
SCHEMBL17968893 0.93 PYGL (0.35) ITGB3ITGA2BHPGDSFEN1ALOX5AP
SCHEMBL17968892 0.93 PYGL (0.35) ITGB3ITGA2BHPGDSFEN1ALOX5AP
SCHEMBL22384167 0.90 KIFC1 (0.33) ACACBFEN1ALOX5APHRH2HRH1
SCHEMBL17834395 0.90 KIFC1 (0.33) ACACBFEN1ALOX5APHRH2HRH1
SCHEMBL22756197 0.90 ITGB3 (0.36) ACACBACEITGB3ITGA2BHPGDS
SCHEMBL16305910 0.90 ITGB3 (0.36) ACACBACEITGB3ITGA2BHPGDS
SCHEMBL17834410 0.89 P2RX7 (0.34) ACACBACEFEN1ALOX5APHRH2
SCHEMBL22384166 0.89 ITGB3 (0.33) ITGB3ITGA2BHPGDSFEN1ALOX5AP
SCHEMBL17834723 0.87 LY96 (0.40) HPGDSFEN1ALOX5APROCK2

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 6 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
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 ACACB 3909/4885ACE 3137/4885ITGB3 4025/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ACACB 3909/4885ACE 3137/4885ITGB3 4025/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ACACB 3721/4885ACE 2924/4885ITGB3 3678/4885

“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.