SCHEMBL4087978

SCHEMBL4087978

O=C(Nc1nn[nH]n1)c1ccc(CN(C(=O)c2cccc(C(F)(F)F)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.55
HDAC11 Q96DB2 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
GIPR P48546 6/20 0.50
GCG P01275 1/20 0.50
STAT3 P40763 1/20 0.44
ADCY8 P40145 1/20 0.44
ADCY1 Q08828 1/20 0.44

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
SCHEMBL13800413 0.91 GCGR (0.53) GCGRGIPRGCGSTAT3
SCHEMBL4085339 0.90 GCGR (0.58) GCGRGIPRGCG
SCHEMBL4082013 0.88 GCGR (0.62) GCGRGIPRSTAT3
SCHEMBL13799984 0.88 GCGR (0.54) GCGRGIPRGCGSTAT3
SCHEMBL2663172 0.88 GCGR (0.56) GCGRGIPRGCGSTAT3
SCHEMBL4091259 0.86 GCGR (0.58) GCGRGIPRGCG
SCHEMBL4092421 0.86 GCGR (0.55) GCGRGIPRGCGSTAT3
SCHEMBL9070989 0.85 GCGR (0.54) GCGRGIPRGCG
SCHEMBL13800864 0.85 GCGR (0.53) GCGRGIPRGCG
SCHEMBL2663543 0.85 GCGR (0.53) GCGRGIPRGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
CN-1356977-A Glucagon antagonists/inverse agonists NOVO NORDISK AS (DK) 2002-07-03 CN 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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885HDAC11 2304/4885HDAC8 2820/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR GCGR 3/4885HDAC11 2304/4885HDAC8 2820/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885HDAC11 2304/4885HDAC8 2820/4885

“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.