SCHEMBL4086811

SCHEMBL4086811

O=C(Nc1cccc(SCC2CC2)c1)NC(c1ccc(C(=O)Nc2nn[nH]n2)cc1)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 7/20 0.42
NAMPT P43490 1/20 0.38
GIPR P48546 3/20 0.38
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
SIRT3 Q9NTG7 1/20 0.36
CCKBR P32239 3/20 0.36
LMNA P02545 1/20 0.36
CCKAR P32238 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
DEGS1 O15121 1/20 0.35
PIK3CD O00329 1/20 0.34
EPHX2 P34913 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
SCHEMBL4082076 0.92 GCGR (0.44) GCGRNAMPTGIPRSIRT2SIRT1
SCHEMBL4081849 0.89 GCGR (0.44) GCGRNAMPTGIPRCCKBRLMNA
SCHEMBL4085646 0.89 GCGR (0.42) GCGRNAMPTGIPRSIRT2SIRT1
SCHEMBL4092786 0.87 GCGR (0.45) GCGRNAMPTGIPRCCKBRLMNA
SCHEMBL4087662 0.85 GCGR (0.46) GCGRNAMPTGIPRCCKBRLMNA
SCHEMBL4081953 0.85 GCGR (0.49) GCGRNAMPTGIPRCCKBRLMNA
SCHEMBL4092648 0.85 GCGR (0.43) GCGRNAMPTGIPRSIRT2SIRT1
SCHEMBL4086482 0.84 GCGR (0.44) GCGRNAMPTGIPRSIRT2SIRT1
SCHEMBL4091638 0.83 GCGR (0.44) GCGRNAMPTGIPRCCKBRLMNA
SCHEMBL4085344 0.83 GCGR (0.46) GCGRGIPREPHX2

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-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-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

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-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR GCGR 3/4885NAMPT 1813/4885GIPR 4/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885NAMPT 1813/4885GIPR 4/4885

“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.