SCHEMBL17834369

SCHEMBL17834369

CC(C)(C)OC(=O)[C@H]1CCN(C(=O)[C@H](Cc2ccc(-c3ncc(Br)cn3)cc2)NC(=O)c2ccc(C(C)(C)C)s2)C1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.41
▸ KMT2A Q03164 3/20 0.39
▸ FPR2 P25090 2/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ PRCP P42785 1/20 0.36
▸ HRH2 P25021 1/20 0.35
▸ HRH1 P35367 1/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ ITGB3 P05106 2/20 0.34
▸ ITGA2B P08514 2/20 0.34
▸ ACE P12821 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34
▸ F10 P00742 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ ACKR3 P25106 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
SCHEMBL28532160 0.94 F10 (0.39) ACACBKMT2AFPR2PRCPITGB3
SCHEMBL17945643 0.94 F10 (0.39) ACACBKMT2AFPR2PRCPITGB3
SCHEMBL28532158 0.94 F10 (0.39) ACACBKMT2AFPR2PRCPITGB3
SCHEMBL16306070 0.94 F10 (0.39) ACACBKMT2AFPR2PRCPITGB3
SCHEMBL16305977 0.94 ACACB (0.35) ACACBKMT2AFPR2MAPK1PRCP
SCHEMBL22384298 0.94 ACACB (0.35) ACACBKMT2AFPR2MAPK1PRCP
SCHEMBL17825459 0.91 PRCP (0.37) KMT2AFPR2PRCPITGB3ITGA2B
SCHEMBL16342611 0.91 PRCP (0.37) KMT2AFPR2PRCPITGB3ITGA2B
SCHEMBL16342612 0.91 PRCP (0.37) KMT2AFPR2PRCPITGB3ITGA2B
SCHEMBL22150105 0.91 PRCP (0.37) KMT2AFPR2PRCPITGB3ITGA2B

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 10 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-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-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
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 3909/4885KMT2A 4232/4885FPR2 492/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ACACB 3909/4885KMT2A 4232/4885FPR2 492/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ACACB 3721/4885KMT2A 3867/4885FPR2 499/4885

“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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