SCHEMBL2653068

SCHEMBL2653068

COC(=O)CCNC(=O)c1ccc(C(Oc2ccc(-c3ccc(C(F)(F)F)cc3)c(C)c2)C(C)C)s1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 9/20 0.38
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
GIPR P48546 1/20 0.35
PPARD Q03181 4/20 0.35
MAPT P10636 1/20 0.34
MCL1 Q07820 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
POLQ O75417 1/20 0.34
PPARA Q07869 1/20 0.34
GCG P01275 1/20 0.34

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
SCHEMBL12056508 1.00 GCGR (0.38) GCGRSLC1A3SLC1A2SLC1A1GIPR
SCHEMBL13647182 1.00 GCGR (0.38) GCGRSLC1A3SLC1A2SLC1A1GIPR
SCHEMBL2660025 1.00 GCGR (0.38) GCGRSLC1A3SLC1A2SLC1A1GIPR
SCHEMBL2655193 0.92 GCGR (0.40) GCGRMAPTPOLQ
SCHEMBL2666454 0.92 GCGR (0.45) GCGRGIPRMCL1GCG
SCHEMBL2652642 0.92 GCGR (0.45) GCGRGIPRMCL1GCG
SCHEMBL2652397 0.92 GCGR (0.40) GCGRMAPTPOLQ
SCHEMBL3338020 0.91 GCGR (0.45) GCGRGIPRPPARDMAPTMCL1
SCHEMBL2653667 0.91 GCGR (0.45) GCGRGIPRPPARDMAPTMCL1
SCHEMBL2653343 0.90 GCGR (0.43) GCGRMAPTPPARA

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 2/4885SLC1A3 3196/4885SLC1A2 3277/4885

“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.