SCHEMBL16375213

SCHEMBL16375213

O=C(NC(Cc1ccc(-c2ncc(-c3ccccc3)cn2)cc1)C(=O)O)c1cccs1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HSPA1A P0DMV8 1/20 0.53
▸ HSPA5 P11021 1/20 0.53
▸ HSPA9 P38646 1/20 0.53
▸ HSPA2 P54652 1/20 0.53
▸ CTSL P07711 1/20 0.51
▸ HPGDS O60760 3/20 0.50
▸ MME P08473 8/20 0.46
▸ ACE2 Q9BYF1 8/20 0.46
▸ ACE P12821 7/20 0.46
▸ CPA1 P15085 6/20 0.46
▸ PTPN1 P18031 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
SCHEMBL17994251 0.90 HSPA5 (0.50) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375203 0.89 CTSL (0.53) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375233 0.86 CTSL (0.54) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375212 0.86 PTPN1 (0.57) MMEACE2ACECPA1PTPN1
SCHEMBL16375201 0.85 CTSL (0.53) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375208 0.85 HSPA5 (0.51) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375214 0.84 HSPA5 (0.46) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL10654990 0.83 CTSL (0.68) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL10654984 0.83 CTSL (0.68) HSPA1AHSPA5HSPA9HSPA2CTSL
SCHEMBL16375205 0.81 HSPA1A (0.43) HSPA1AHSPA5HSPA9HSPA2CTSL

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2017-11-02 — — US disclosed
US-9598430-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-03-21 — — US disclosed
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-07-28 — — US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — 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 (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-20170313717-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HSPA1A 2012/4885HSPA5 3669/4885HSPA9 2536/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HSPA1A 2012/4885HSPA5 3669/4885HSPA9 2536/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HSPA1A 2012/4885HSPA5 3669/4885HSPA9 2536/4885

“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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