SCHEMBL16375210

SCHEMBL16375210

O=C(NC(Cc1ccc(-c2ncc(-c3ccccc3)cn2)cc1)C(=O)N1CCCC1C(=O)O)c1cccs1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.51
▸ ACE P12821 16/20 0.51
▸ ACE2 Q9BYF1 10/20 0.51
▸ MME P08473 1/20 0.47
▸ MMEL1 Q495T6 1/20 0.47

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
SCHEMBL17994248 0.92 ACE (0.50) TSHRACEACE2MMEMMEL1
SCHEMBL16375206 0.89 TSHR (0.63) TSHRACEACE2
SCHEMBL17834576 0.86 ACE (0.49) TSHRACEACE2MMEMMEL1
SCHEMBL16375207 0.85 RAB9A (0.43) —
SCHEMBL16375205 0.83 HSPA1A (0.43) MME
SCHEMBL17994250 0.82 ACE (0.63) TSHRACEACE2
SCHEMBL16375214 0.82 HSPA5 (0.46) TSHR
SCHEMBL16375213 0.81 HSPA1A (0.53) ACEACE2MME
SCHEMBL15037081 0.81 ACE (0.46) TSHRACEACE2MMEMMEL1
SCHEMBL15037086 0.81 ACE (0.46) TSHRACEACE2MMEMMEL1

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 4 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

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 TSHR 45/4885ACE 3137/4885ACE2 3162/4885
US-20160214993-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R TSHR 45/4885ACE 3137/4885ACE2 3162/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R TSHR 45/4885ACE 3137/4885ACE2 3162/4885

“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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