SCHEMBL17834761

SCHEMBL17834761

CC[C@H]1CC[C@H](c2ccc(-c3cnc(-c4ccc(C[C@H](NC(=O)c5ccc(C(C)(C)C)s5)C(=O)N[C@@H](CO)C(=O)O)cc4)nc3)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PSMB10 P40306 6/20 0.34
▸ PSMB2 P49721 6/20 0.34
▸ KIFC1 Q9BW19 2/20 0.34
▸ DGAT1 O75907 1/20 0.34
▸ KLKB1 P03952 2/20 0.33
▸ ACE P12821 7/20 0.33
▸ MME P08473 6/20 0.33
▸ CPA1 P15085 6/20 0.33
▸ ACE2 Q9BYF1 6/20 0.33
▸ F2 P00734 1/20 0.32

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
SCHEMBL17825447 0.94 KIFC1 (0.38) KIFC1DGAT1ACEMMECPA1
SCHEMBL17825449 0.94 KIFC1 (0.38) KIFC1DGAT1ACEMMECPA1
SCHEMBL17834920 0.94 KIFC1 (0.38) KIFC1DGAT1ACEMMECPA1
SCHEMBL17825448 0.94 KIFC1 (0.38) KIFC1DGAT1ACEMMECPA1
SCHEMBL17834579 0.93 ACE (0.33) PSMB10PSMB2KIFC1DGAT1KLKB1
SCHEMBL17834510 0.92 MME (0.36) PSMB2KIFC1DGAT1KLKB1MME
SCHEMBL17834549 0.92 MME (0.36) PSMB2KIFC1DGAT1KLKB1MME
SCHEMBL17968971 0.92 MME (0.36) PSMB2KIFC1DGAT1KLKB1MME
SCHEMBL17834602 0.92 MME (0.36) PSMB2KIFC1DGAT1KLKB1MME
SCHEMBL17968983 0.92 MME (0.36) PSMB2KIFC1DGAT1KLKB1MME

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 8 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-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 PSMB10 2845/4885PSMB2 3237/4885KIFC1 4738/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R PSMB10 2845/4885PSMB2 3237/4885KIFC1 4738/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR PSMB10 3043/4885PSMB2 3577/4885KIFC1 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.

Send feedback