SCHEMBL2653516

SCHEMBL2653516

COc1cc(NC(=O)NC(c2ccc(C(=O)NC[C@@H](O)C(=O)O)cc2)c2ccc(C3CCCCC3)cc2)cc(C(F)(F)F)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.70
GIPR P48546 13/20 0.70
GLP1R P43220 2/20 0.47
EPHX2 P34913 1/20 0.42
CCR3 P51677 2/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
ADCY8 P40145 1/20 0.40
ADCY1 Q08828 1/20 0.40
TRPV1 Q8NER1 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
SCHEMBL2653513 1.00 GCGR (0.70) GCGRGIPRGLP1REPHX2CCR3
SCHEMBL2646134 0.92 GCGR (0.60) GCGRGIPRGLP1REPHX2CCR3
SCHEMBL2646135 0.92 GCGR (0.60) GCGRGIPRGLP1REPHX2CCR3
SCHEMBL2653112 0.89 GCGR (0.55) GCGRGIPRGLP1REPHX2CCR3
SCHEMBL2653116 0.89 GCGR (0.55) GCGRGIPRGLP1REPHX2CCR3
SCHEMBL2652334 0.88 GCGR (0.58) GCGRGIPRGLP1REPHX2
SCHEMBL2652335 0.88 GCGR (0.58) GCGRGIPRGLP1REPHX2
SCHEMBL2652737 0.84 GCGR (0.73) GCGRGIPRGLP1REPHX2
SCHEMBL2652733 0.84 GCGR (0.73) GCGRGIPRGLP1REPHX2
SCHEMBL2654195 0.84 GCGR (0.53) GCGRGIPRGLP1REPHX2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6953812-B2 Glucagon antagonists/inverse agonists NOVO NORDISK, INC. (DK) 2005-10-11 US claimed
WO-2004063147-A1 SALTS AND SOLVATES OF GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-07-29 WO claimed
US-6562807-B2 For prophylaxis and therapy of hyperglycemia, Type 1 diabetes, Type 2 diabetes, disorders of the lipid metabolism, such as dyslipidemia, and obesity NOVO NORDISK A/S (DK) 2003-05-13 US claimed
US-6953812-B2 Glucagon antagonists/inverse agonists NOVO NORDISK, INC. (DK) 2005-10-11 US disclosed
WO-2004063147-A1 SALTS AND SOLVATES OF GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-07-29 WO disclosed
US-20040024045-A1 Glucagon antagonists/inverse agonists PFIZER INC 2004-02-05 US disclosed
US-6562807-B2 For prophylaxis and therapy of hyperglycemia, Type 1 diabetes, Type 2 diabetes, disorders of the lipid metabolism, such as dyslipidemia, and obesity NOVO NORDISK A/S (DK) 2003-05-13 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 (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-20040024045-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885GIPR 4/4885GLP1R 1/4885

“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.