Sugi Predict

Sugi Predict / Compounds / SCHEMBL2665367

SCHEMBL2665367

SCHEMBL2665367

O=C(NC[C@@H](O)C(=O)O)c1ccc(CN(/C(=C\[N+](=O)[O-])Nc2cc(Br)cc(C(F)(F)F)c2)c2ccc(C3=CCCCC3)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 20/20 0.80
▸ GIPR P48546 20/20 0.80
▸ GLP1R P43220 6/20 0.58

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
SCHEMBL2665455 0.95 GCGR (0.72) GCGRGIPRGLP1R
SCHEMBL2665421 0.89 GCGR (0.63) GCGRGIPRGLP1R
SCHEMBL2653040 0.89 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL2653030 0.89 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL2665372 0.88 GCGR (0.86) GCGRGIPRGLP1R
SCHEMBL9071006 0.85 GCGR (0.81) GCGRGIPRGLP1R
SCHEMBL2665393 0.85 GCGR (0.81) GCGRGIPRGLP1R
SCHEMBL2665432 0.85 GCGR (0.61) GCGRGIPRGLP1R
SCHEMBL2665580 0.84 GCGR (0.91) GCGRGIPRGLP1R
SCHEMBL2665539 0.84 GCGR (0.81) GCGRGIPRGLP1R

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