SCHEMBL4081849

SCHEMBL4081849

CSc1cccc(NC(=O)NC(c2ccc(C(=O)Nc3nn[nH]n3)cc2)c2ccc(C3CCCCC3)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 5/20 0.44
GIPR P48546 3/20 0.44
ADCY1 Q08828 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
NAMPT P43490 1/20 0.40
CCKBR P32239 2/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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) GCGRGIPRNAMPTCCKBRLMNA
SCHEMBL4085646 0.92 GCGR (0.42) GCGRGIPRADCY1NAMPTCCKBR
SCHEMBL4092558 0.90 GCGR (0.44) GCGRGIPRADCY1NAMPTLMNA
SCHEMBL4092786 0.90 GCGR (0.45) GCGRGIPRRXFP1NAMPTCCKBR
SCHEMBL4087662 0.90 GCGR (0.46) GCGRGIPRNAMPTCCKBRLMNA
SCHEMBL4086811 0.89 GCGR (0.42) GCGRGIPRNAMPTCCKBRLMNA
SCHEMBL4086482 0.88 GCGR (0.44) GCGRGIPRADCY1MEN1KMT2A
SCHEMBL4081953 0.88 GCGR (0.49) GCGRGIPRADCY1NAMPTCCKBR
SCHEMBL4091638 0.88 GCGR (0.44) GCGRGIPRADCY1RXFP1NAMPT
SCHEMBL4085175 0.87 GCGR (0.43) GCGRGIPRADCY1MEN1KMT2A

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-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

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 3/4885GIPR 4/4885ADCY1 435/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR GCGR 3/4885GIPR 4/4885ADCY1 435/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885GIPR 4/4885ADCY1 435/4885

“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.