SCHEMBL2665443

SCHEMBL2665443

O=C(NC[C@@H](O)C(=O)O)c1ccc(CN(/C(=C\[N+](=O)[O-])Nc2cc(Cl)cc(Cl)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCGR P47871 20/20 0.78
GIPR P48546 18/20 0.78
GLP1R P43220 5/20 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
SCHEMBL2665440 0.90 GCGR (0.69) GCGRGIPRGLP1R
SCHEMBL2665365 0.88 GCGR (0.64) GCGRGIPRGLP1R
SCHEMBL6754633 0.88 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL2653498 0.88 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL6754634 0.88 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL2665371 0.86 GCGR (0.85) GCGRGIPRGLP1R
SCHEMBL2665429 0.85 GCGR (0.62) GCGRGIPRGLP1R
SCHEMBL2665441 0.85 GCGR (0.60) GCGRGIPRGLP1R
SCHEMBL2665678 0.82 GCGR (0.88) GCGRGIPRGLP1R
SCHEMBL2665415 0.81 GCGR (0.51) GCGRGIPR

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-2003051357-A1 GLUCAGON RECEPTOR ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed