SCHEMBL2665207

SCHEMBL2665207

CC(C)c1ccc(NC(=O)C(Cc2ccc(C(=O)NCCC(=O)O)cc2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.62
ADCY6 O43306 7/20 0.62
ADCY3 O60266 7/20 0.62
ADCY9 O60503 7/20 0.62
ADCY5 O95622 7/20 0.62
ADCY8 P40145 7/20 0.62
ADCY7 P51828 7/20 0.62
ADCY2 Q08462 7/20 0.62
ADCY1 Q08828 7/20 0.62
ADCY4 Q8NFM4 7/20 0.62
EPHX2 P34913 1/20 0.44
CYP2D6 P10635 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL2665139 0.93 GCGR (0.62) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665003 0.93 GCGR (0.62) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665102 0.92 GCGR (0.63) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665104 0.91 GCGR (0.60) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL9071465 0.91 GCGR (0.59) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL6914241 0.90 GCGR (0.63) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665200 0.89 GCGR (0.55) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665105 0.89 GCGR (0.55) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2665043 0.88 GCGR (0.57) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2664986 0.88 GCGR (0.54) GCGRADCY6ADCY3ADCY9ADCY5

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-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed