SCHEMBL2647030

SCHEMBL2647030

O=C(O)CCNC(=O)c1ccc(C(=O)C(CC(=O)c2ccc(N3CCCCC3)cc2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCGR P47871 12/20 0.51
EPHX2 P34913 1/20 0.42
ADRB3 P13945 1/20 0.42
GCG P01275 1/20 0.40
HAO1 Q9UJM8 1/20 0.40
CYP2D6 P10635 1/20 0.40
APAF1 O14727 1/20 0.40
GIPR P48546 2/20 0.39
GLP1R P43220 1/20 0.39
SMYD3 Q9H7B4 1/20 0.39

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
SCHEMBL2653731 0.92 HAO1 (0.46) GCGREPHX2HAO1CYP2D6APAF1
SCHEMBL2654474 0.87 HAO1 (0.42) GCGREPHX2HAO1CYP2D6APAF1
SCHEMBL2647125 0.87 CYP2D6 (0.45) GCGRGCGHAO1CYP2D6APAF1
SCHEMBL2660182 0.86 GCGR (0.45) GCGRGCGHAO1CYP2D6APAF1
SCHEMBL2647568 0.86 GCGR (0.45) GCGRGCGHAO1CYP2D6APAF1
SCHEMBL2646694 0.86 GCGR (0.49) GCGRHAO1CYP2D6APAF1
SCHEMBL6756859 0.86 GCGR (0.49) GCGRHAO1CYP2D6APAF1
SCHEMBL6755406 0.86 GCGR (0.49) GCGRHAO1CYP2D6APAF1
SCHEMBL2653410 0.85 CYP2D6 (0.44) GCGREPHX2GCGHAO1CYP2D6
SCHEMBL2647801 0.84 GCGR (0.46) GCGRGCGHAO1CYP2D6APAF1

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
EP-1463715-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-10-06 EP disclosed
US-6762318-B2 CARBOXYLIC ACID OR TETRAZOLE DERIVATIZED SECONDARY AMIDES; ORAL ADMINISTRATION NOVO NORDISK A/S (DK) 2004-07-13 US disclosed
US-20030236292-A1 Stimulant releasing glucose from liver cells; antidiabetic agents PFIZER INC 2003-12-25 US disclosed
WO-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed
WO-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO 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-20030236292-A1 Stimulant releasing glucose from liver cells; antidiabetic agents GPR119, GLP1R, GIPR GCGR 4/4885EPHX2 4354/4885ADRB3 119/4885

“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.