SCHEMBL4091869

SCHEMBL4091869

CCCCc1ccc(C(NC(=O)Nc2cccc([N+](=O)[O-])c2)c2ccc(C(=O)Nc3nn[nH]n3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA9 Q16790 1/20 0.44
MEN1 O00255 9/20 0.42
KMT2A Q03164 9/20 0.42
CYSLTR2 Q9NS75 5/20 0.42
CYSLTR1 Q9Y271 5/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL4081375 0.87 TRPV1 (0.55) CYSLTR2CYSLTR1MAPTTRPV1
SCHEMBL4081065 0.86 MEN1 (0.59) CA12CA1CA9MEN1KMT2A
SCHEMBL4085620 0.85 CYSLTR2 (0.42) CA12CA1CA9MEN1KMT2A
SCHEMBL4091863 0.82 GCGR (0.49) ABCG2CA12CA1CA9MEN1
SCHEMBL4096175 0.82 MGAT2 (0.40) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL4091878 0.81 RAB9A (0.45) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL4092624 0.78 GCGR (0.53)
SCHEMBL4081625 0.74 ALDH1A1 (0.43) CA12CA1CA9MEN1KMT2A
SCHEMBL4097734 0.74 GCGR (0.51) KMT2ANPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4092088 0.73 GCGR (0.47) CA12CA1CA9MEN1KMT2A

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 ABCG2 2759/4885CA12 4759/4885CA1 4464/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR ABCG2 2759/4885CA12 4759/4885CA1 4464/4885

“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.