SCHEMBL2655745

SCHEMBL2655745

CCOC(=O)CCNC(=O)c1ccc(C(CC(C)C)Oc2cc(C)c(-c3ccccc3)c(C)c2)s1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
MCL1 Q07820 1/20 0.36
AURKA O14965 1/20 0.35
KIFC1 Q9BW19 1/20 0.35
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
ACKR3 P25106 2/20 0.33
GCG P01275 2/20 0.33
PARP1 P09874 1/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL2655746 1.00 GCGR (0.39) GCGRPPARGPPARAMCL1AURKA
SCHEMBL2653997 0.91 GCGR (0.46) GCGRPPARGPPARAACKR3GCG
SCHEMBL2653995 0.91 GCGR (0.46) GCGRPPARGPPARAACKR3GCG
SCHEMBL2666475 0.85 GCGR (0.47) GCGRPPARGPPARAACKR3GCG
SCHEMBL2654235 0.85 GCGR (0.47) GCGRPPARGPPARAACKR3GCG
SCHEMBL2655034 0.84 GCGR (0.46) GCGRPPARGPPARAGCG
SCHEMBL2655037 0.84 GCGR (0.46) GCGRPPARGPPARAGCG
SCHEMBL2653951 0.83 GCGR (0.50) GCGRGCG
SCHEMBL2653949 0.83 GCGR (0.50) GCGRGCG
SCHEMBL2654083 0.82 GCGR (0.46) GCGRMCL1MAPTGCG

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-8084489-B2 Glucagon receptor antagonists, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2011-12-27 US disclosed
US-20100137417-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses ELI LILLY AND COMPANY 2010-06-03 US disclosed
EP-1856090-B1 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2009-10-14 EP disclosed
EP-1856090-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-11-21 EP disclosed
WO-2006086488-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-08-17 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 (1 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-20100137417-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses GLP1R, GCGR, GIPR GCGR 2/4885PPARG 90/4885PPARA 211/4885

“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.