SCHEMBL2647568

SCHEMBL2647568

O=C(O)CCNC(=O)c1ccc(C(=O)C(CC(=O)c2ccc(-c3ccccc3)cc2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 11/20 0.45
ADCY6 O43306 2/20 0.45
ADCY3 O60266 2/20 0.45
ADCY9 O60503 2/20 0.45
ADCY5 O95622 2/20 0.45
ADCY8 P40145 2/20 0.45
ADCY7 P51828 2/20 0.45
ADCY2 Q08462 2/20 0.45
ADCY1 Q08828 2/20 0.45
ADCY4 Q8NFM4 2/20 0.45
CYP2D6 P10635 1/20 0.45
APAF1 O14727 1/20 0.43
HAO1 Q9UJM8 1/20 0.42
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRK1 P41145 1/20 0.40

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
SCHEMBL2660182 1.00 GCGR (0.45) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2653731 0.94 HAO1 (0.46) GCGRCYP2D6APAF1HAO1SMN1; SMN2
SCHEMBL2647801 0.90 GCGR (0.46) GCGRCYP2D6APAF1HAO1SMN1; SMN2
SCHEMBL2654474 0.90 HAO1 (0.42) GCGRCYP2D6APAF1HAO1
SCHEMBL2647125 0.90 CYP2D6 (0.45) GCGRCYP2D6APAF1HAO1SMN1; SMN2
SCHEMBL6756859 0.88 GCGR (0.49) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2646694 0.88 GCGR (0.49) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL6755406 0.88 GCGR (0.49) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2653410 0.87 CYP2D6 (0.44) GCGRCYP2D6APAF1HAO1OPRM1
SCHEMBL2646962 0.86 GCGR (0.44) GCGRCYP2D6APAF1HAO1SMN1; SMN2

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 4/4885ADCY6 1234/4885ADCY3 1102/4885

“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.