SCHEMBL17994243

SCHEMBL17994243

Cc1cnc(-c2ccc(CC(NC(=O)c3cccs3)C(=O)NC(C)C(=O)O)cc2)nc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 4/20 0.50
HSPA2 P54652 2/20 0.50
HSPA1A P0DMV8 1/20 0.50
HSPA9 P38646 1/20 0.50
CTSL P07711 1/20 0.50
MME P08473 2/20 0.46
ANPEP P15144 2/20 0.46
HPGDS O60760 4/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL16375203 0.92 CTSL (0.53) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL17994251 0.90 HSPA5 (0.50) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL17994242 0.89 HSPA5 (0.48) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL17994239 0.87 MME (0.49) CTSLMMEANPEP
SCHEMBL17994240 0.85 CTSL (0.53) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL16375208 0.81 HSPA5 (0.51) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL16375213 0.81 HSPA1A (0.53) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL16375200 0.80 MME (0.53) CTSLMMEANPEP
SCHEMBL17994253 0.80 HSPA5 (0.43) HSPA5HSPA2HSPA1AHSPA9CTSL
SCHEMBL17834782 0.78 MME (0.45) MMEANPEPHPGDS

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-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

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 HSPA5 3669/4885HSPA2 3462/4885HSPA1A 2012/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R HSPA5 3669/4885HSPA2 3462/4885HSPA1A 2012/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR HSPA5 3743/4885HSPA2 3475/4885HSPA1A 2012/4885

“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.