SCHEMBL6750387

SCHEMBL6750387

O=C(O)CCNC(=O)c1ccc(C(NC(=O)Nc2cccc(I)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCGR P47871 9/20 0.50
EPHX2 P34913 3/20 0.46
CYP2D6 P10635 1/20 0.42
GIPR P48546 3/20 0.41
NAMPT P43490 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
DEGS1 O15121 1/20 0.38
FOLH1 Q04609 2/20 0.38
SERPINE1 P05121 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 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
SCHEMBL2651118 0.91 GCGR (0.47) GCGREPHX2CYP2D6GIPR
SCHEMBL2652582 0.90 GCGR (0.51) GCGREPHX2CYP2D6GIPRNAMPT
SCHEMBL2653146 0.90 GCGR (0.50) GCGREPHX2CYP2D6GIPR
SCHEMBL2650399 0.90 GCGR (0.50) GCGREPHX2CYP2D6GIPRSERPINE1
SCHEMBL2652649 0.90 GCGR (0.50) GCGREPHX2CYP2D6GIPR
SCHEMBL2651718 0.90 GCGR (0.50) GCGREPHX2CYP2D6GIPR
SCHEMBL2658771 0.88 GCGR (0.53) GCGREPHX2CYP2D6GIPRSIRT2
SCHEMBL2658281 0.87 GCGR (0.50) GCGREPHX2CYP2D6GIPRSIRT2
SCHEMBL6748291 0.87 GCGR (0.53) GCGREPHX2CYP2D6GIPRHDAC3
SCHEMBL2651304 0.87 GCGR (0.48) GCGREPHX2GIPRHDAC8

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
US-20030065031-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-04-03 US 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 (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-20040127560-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885EPHX2 2973/4885CYP2D6 3508/4885
US-20030065031-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885EPHX2 2973/4885CYP2D6 3508/4885

“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.