SCHEMBL2650221

SCHEMBL2650221

Cc1ccc(NC(=O)NC(c2ccc(C(=O)NCCC(=O)O)cc2)c2ccc(C3CCCCC3)cc2)cc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 3/20 0.50
RAB9A P51151 5/20 0.43
NPC1 O15118 3/20 0.43
MAPT P10636 5/20 0.42
LMNA P02545 4/20 0.42
KMT2A Q03164 3/20 0.42
MAPK1 P28482 2/20 0.42
MEN1 O00255 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX2 P34913 2/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
CYP2D6 P10635 1/20 0.38

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
SCHEMBL7101976 0.92 GCGR (0.44) GCGRRAB9ANPC1MAPTLMNA
SCHEMBL4092096 0.86 GCGR (0.67) GCGRRAB9ANPC1MAPTKMT2A
SCHEMBL6751922 0.85 EPHX2 (0.42) GCGRMAPTLMNASMN1; SMN2EPHX2
SCHEMBL4081733 0.84 EPHX2 (0.45) GCGREPHX2CYP2D6
SCHEMBL2651702 0.84 GCG (0.43) GCGRRAB9ANPC1MAPTLMNA
SCHEMBL2651718 0.84 GCGR (0.50) GCGRRAB9ANPC1MAPTLMNA
SCHEMBL2651057 0.83 GCGR (0.46) GCGRRAB9ANPC1MAPTLMNA
SCHEMBL2653146 0.82 GCGR (0.50) GCGRNPC1MAPTKMT2AMEN1
SCHEMBL6754090 0.81 EPHX2 (0.45) GCGRNPC1MAPTLMNAKMT2A
SCHEMBL2650215 0.81 GCGR (0.76) GCGRRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127560-A1 Glucagon antagonists/inverse agonists MADSEN PETER (DK) 2004-07-01 US claimed
US-6706744-B2 HYPOGLYCEMIC AGENTS; ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2004-03-16 US claimed
WO-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20040127560-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885RAB9A 2872/4885NPC1 822/4885

“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.