SCHEMBL2656182

SCHEMBL2656182

CC(C)(C)c1ccc(C(Cc2ccc(C(=O)NCCC(=O)O)cc2)c2nc(-c3ccc(F)cc3)cs2)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 19/20 0.73
GIPR P48546 8/20 0.73
ADCY6 O43306 6/20 0.52
ADCY3 O60266 6/20 0.52
ADCY9 O60503 6/20 0.52
ADCY5 O95622 6/20 0.52
ADCY8 P40145 6/20 0.52
ADCY7 P51828 6/20 0.52
ADCY2 Q08462 6/20 0.52
ADCY1 Q08828 6/20 0.52
ADCY4 Q8NFM4 6/20 0.52
MAPT P10636 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
SCHEMBL2649467 0.93 GCGR (0.84) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2654058 0.92 GCGR (0.84) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL6135453 0.90 GCGR (0.84) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2655986 0.89 GCGR (0.68) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL9071222 0.88 GCGR (0.66) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2648935 0.88 GCGR (0.87) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2648419 0.85 GCGR (1.00) GCGRGIPRMAPT
SCHEMBL2647099 0.84 GCGR (0.92) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2647393 0.83 GCGR (0.87) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2648190 0.80 GCGR (1.00) GCGRGIPRADCY6ADCY3ADCY9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256175-A1 Novel glucagon antagonists/inverse agonists LAU JESPER 2005-11-17 US disclosed
US-6881746-B2 Glucagon antagonists/inverse agonists NOVO NORDICK A/S (DK) 2005-04-19 US disclosed
EP-1519723-A1 NOVEL GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2005-04-06 EP disclosed
US-20040014789-A1 Novel glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2004-01-22 US disclosed
WO-2004002480-A1 NOVEL GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed
WO-2004002480-A1 NOVEL GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2004-01-08 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 (2 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-20040014789-A1 Novel glucagon antagonists/inverse agonists GLP1R, GCGR, GIPR GCGR 2/4885GIPR 3/4885ADCY6 587/4885
US-20050256175-A1 Novel glucagon antagonists/inverse agonists GLP1R, GCGR, GIPR GCGR 2/4885GIPR 3/4885ADCY6 587/4885

“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.