SCHEMBL2665072

SCHEMBL2665072

CC1CCCC(c2ccc(C(CC(=O)c3cc(Cl)cc(Cl)c3)C(=O)c3ccc(C(=O)NC[C@@H](O)C(=O)O)cc3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.47
GIPR P48546 10/20 0.47
GLP1R P43220 2/20 0.36
SERPINE1 P05121 1/20 0.35
BCL2L1 Q07817 2/20 0.35
MCL1 Q07820 2/20 0.35
POLB P06746 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
SCHEMBL2648952 0.81 GCGR (0.48) GCGRGIPRSERPINE1BCL2L1MCL1
SCHEMBL2648950 0.81 GCGR (0.48) GCGRGIPRSERPINE1BCL2L1MCL1
SCHEMBL2665144 0.78 GCGR (0.51) GCGRGIPRGLP1RSERPINE1BCL2L1
SCHEMBL6916484 0.78 GCGR (0.53) GCGRGIPRGLP1RBCL2L1MCL1
SCHEMBL6916489 0.78 GCGR (0.53) GCGRGIPRGLP1RBCL2L1MCL1
SCHEMBL2645898 0.77 GCGR (0.46) GCGRGIPRSERPINE1BCL2L1MCL1
SCHEMBL2645893 0.77 GCGR (0.46) GCGRGIPRSERPINE1BCL2L1MCL1
SCHEMBL2665081 0.77 GCGR (0.49) GCGRGIPRGLP1RSERPINE1BCL2L1
SCHEMBL9071434 0.75 GCGR (0.55) GCGRGIPR
SCHEMBL2659967 0.74 GCGR (0.47) GCGRGIPRGLP1RSERPINE1BCL2L1

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-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed