SCHEMBL2663115

SCHEMBL2663115

O=C(O)CCNC(=O)c1ccc(CN(C(=O)Nc2ccc(O)cc2)C2CCC3CCCCC3C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 20/20 0.60
GIPR P48546 2/20 0.56
ADCY6 O43306 1/20 0.56
ADCY3 O60266 1/20 0.56
ADCY9 O60503 1/20 0.56
ADCY5 O95622 1/20 0.56
ADCY8 P40145 1/20 0.56
GLP1R P43220 1/20 0.56
ADCY7 P51828 1/20 0.56
ADCY2 Q08462 1/20 0.56
ADCY1 Q08828 1/20 0.56
ADCY4 Q8NFM4 1/20 0.56

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
SCHEMBL9072709 0.95 GCGR (0.65) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL4085478 0.88 GCGR (0.75) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2663032 0.86 GCGR (0.68) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL6190960 0.85 GCGR (0.69) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2663100 0.84 GCGR (0.68) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2663117 0.83 GCGR (0.86) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2663173 0.83 GCGR (0.69) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2663023 0.82 GCGR (0.79) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2652349 0.82 GCGR (0.63) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL4258393 0.82 GCGR (0.79) GCGRGIPRADCY6ADCY3ADCY9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed