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SCHEMBL2651333

SCHEMBL2651333

Cc1ccsc1NC(=O)NC(c1ccc(C(=O)NCCC(=O)O)cc1)c1ccc(C2=CCCCC2)cc1.Cc1ccsc1NC(=O)NC(c1ccc(C(=O)NCCC(=O)O)cc1)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 13/20 0.41
▸ GIPR P48546 6/20 0.41
▸ GLP1R P43220 1/20 0.41
▸ OPRM1 P35372 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ GCG P01275 2/20 0.34
▸ CCR5 P51681 1/20 0.34

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
SCHEMBL2651490 0.93 GCGR (0.46) GCGRGIPRGLP1RHRH3GCG
SCHEMBL2650119 0.91 GCGR (0.41) GCGROPRM1OPRK1CYP2D6EPHX2
SCHEMBL7108333 0.88 GCGR (0.51) GCGRGIPRGLP1R
SCHEMBL2649840 0.87 GCGR (0.42) GCGRGIPRGLP1RGCG
SCHEMBL2651331 0.86 GCGR (0.46) GCGRGIPRGLP1RHRH3
SCHEMBL2651093 0.84 GCGR (0.41) GCGROPRM1OPRK1CYP2D6EPHX2
SCHEMBL2651259 0.83 GCGR (0.34) GCGRGIPRGLP1ROPRM1OPRK1
SCHEMBL2654303 0.83 GCGR (0.41) GCGRGIPRGLP1ROPRM1OPRK1
SCHEMBL2651118 0.81 GCGR (0.47) GCGRGIPRGLP1ROPRM1OPRK1
SCHEMBL2650819 0.80 OPRM1 (0.40) GCGRGIPRGLP1ROPRM1OPRK1

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