SCHEMBL16343330

SCHEMBL16343330

CC(NC(=O)C(Cc1ccc(-c2ncc(Br)cn2)cc1)NC(=O)OCc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 6/20 0.49
▸ CTSB P07858 5/20 0.49
▸ TACR1 P25103 2/20 0.48
▸ CTSS P25774 3/20 0.47
▸ CTSK P43235 3/20 0.47
▸ CAPN1 P07384 1/20 0.47
▸ P2RX7 Q99572 1/20 0.46
▸ BCL2 P10415 1/20 0.46
▸ TGM2 P21980 1/20 0.46

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
SCHEMBL16343329 1.00 CTSL (0.49) CTSLCTSBTACR1CTSSCTSK
SCHEMBL16343328 1.00 CTSL (0.49) CTSLCTSBTACR1CTSSCTSK
SCHEMBL15019911 0.91 ITGB3 (0.48) CTSLCTSBTACR1CTSSCTSK
SCHEMBL15019914 0.91 ITGB3 (0.48) CTSLCTSBTACR1CTSSCTSK
SCHEMBL16295347 0.90 CAPN1 (0.55) CTSLCTSBTACR1CTSSCTSK
SCHEMBL30065143 0.86 CTSL (0.62) CTSLCTSBTACR1CTSSCTSK
SCHEMBL30645061 0.85 CTSL (0.61) CTSLCTSBTACR1CTSSCTSK
SCHEMBL16305637 0.84 ITGB3 (0.50) CTSLCTSSCTSKBCL2
SCHEMBL22167246 0.83 ALDH1A1 (0.54) CTSLCTSBTACR1CTSSCTSK
SCHEMBL16294752 0.83 ITGB3 (0.56) CTSLCTSBTACR1CTSS

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
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
US-9260427-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2016-02-16 — — US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — US 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 (4 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 CTSL 1635/4885CTSB 1692/4885TACR1 202/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R CTSL 1635/4885CTSB 1692/4885TACR1 202/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR CTSL 1620/4885CTSB 1992/4885TACR1 320/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R CTSL 1635/4885CTSB 1692/4885TACR1 202/4885

“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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