SCHEMBL2665017

SCHEMBL2665017

O=C(O)CCNC(=O)c1ccc(CC(C(=O)Nc2nc3cc(F)c(C(F)(F)F)cc3s2)c2ccc(C3=CCCCC3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 20/20 0.46
GIPR P48546 9/20 0.46
ADCY6 O43306 6/20 0.44
ADCY3 O60266 6/20 0.44
ADCY9 O60503 6/20 0.44
ADCY5 O95622 6/20 0.44
ADCY8 P40145 6/20 0.44
ADCY7 P51828 6/20 0.44
ADCY2 Q08462 6/20 0.44
ADCY1 Q08828 6/20 0.44
ADCY4 Q8NFM4 6/20 0.44
GLP1R P43220 1/20 0.41

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
SCHEMBL9071451 0.91 GCGR (0.45) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2665252 0.91 GCGR (0.45) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL9071426 0.89 GCGR (0.46) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL6752763 0.88 GCGR (0.45) GCGRGIPRGLP1R
SCHEMBL2665176 0.87 GCGR (0.49) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL9071445 0.86 GCGR (0.54) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2665010 0.86 GCGR (0.44) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2664970 0.86 GCGR (0.55) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2664968 0.86 GCGR (0.56) GCGRGIPRADCY6ADCY3ADCY9
SCHEMBL2665018 0.86 GCGR (0.44) 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-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed