SCHEMBL2665583

SCHEMBL2665583

O=C(NC[C@@H](O)C(=O)O)c1ccc(CN(C(=O)Nc2ccc(OC(F)(F)F)c(-c3nc4ccccc4s3)c2)c2ccc(C3=CCCCC3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCGR P47871 19/20 0.68
GIPR P48546 18/20 0.68
GLP1R P43220 4/20 0.58
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 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
SCHEMBL9071754 0.88 GCGR (0.60) GCGRGIPRGLP1RMEN1MAPT
SCHEMBL2665523 0.87 GCGR (0.71) GCGRGIPRGLP1R
SCHEMBL9072764 0.85 GCGR (0.49) GCGRGIPRGLP1RMEN1MAPT
SCHEMBL2665608 0.83 GCGR (0.79) GCGRGIPRGLP1R
SCHEMBL2665601 0.83 GCGR (0.72) GCGRGIPRGLP1R
SCHEMBL9071767 0.82 GCGR (0.64) GCGRGIPRGLP1R
SCHEMBL9071768 0.82 GCGR (0.63) GCGRGIPRGLP1R
SCHEMBL6288852 0.81 GCGR (1.00) GCGRGIPRGLP1R
SCHEMBL9071698 0.81 GCGR (0.72) GCGRGIPRGLP1R
SCHEMBL2665528 0.81 GCGR (0.77) 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-2002000612-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-01-03 WO disclosed