SCHEMBL2650784

SCHEMBL2650784

O=C(CCNC(=O)c1ccc(CN(C(=O)Nc2ccc(OC(F)(F)F)c(-c3nc4ccccc4o3)c2)c2ccc(C3=CCCCC3)cc2)cc1)OC(=O)CCNC(=O)c1ccc(CN(C(=O)Nc2ccc(OC(F)(F)F)c(-c3nc4ccccc4o3)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCGR P47871 20/20 0.52
GIPR P48546 18/20 0.48
GLP1R P43220 4/20 0.46

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
SCHEMBL2650782 0.95 GCGR (0.59) GCGRGIPRGLP1R
SCHEMBL6752428 0.89 GCGR (0.66) GCGRGIPRGLP1R
SCHEMBL2666060 0.89 GCGR (0.58) GCGRGIPRGLP1R
SCHEMBL2651295 0.83 GCGR (0.64) GCGRGIPRGLP1R
SCHEMBL2650786 0.83 GCGR (0.42) GCGRGIPRGLP1R
SCHEMBL2663181 0.82 GCGR (0.48) GCGRGIPR
SCHEMBL4091720 0.81 GCGR (0.52) GCGRGIPR
SCHEMBL2651066 0.79 GCGR (0.54) GCGRGIPRGLP1R
SCHEMBL2651117 0.79 GCGR (0.59) GCGRGIPRGLP1R
SCHEMBL2651291 0.78 GCGR (0.73) 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-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO claimed