SCHEMBL2663548

SCHEMBL2663548

O=C(O)CCNC(=O)c1ccc(CN(Cc2ccc(Cl)c(Cl)c2)C(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.56
EGFR P00533 4/20 0.49
ERBB2 P04626 4/20 0.49
GLP1R P43220 3/20 0.46
GIPR P48546 2/20 0.46
KDM4E B2RXH2 1/20 0.45
ESRRG P62508 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 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
SCHEMBL9072677 0.86 EGFR (0.62) GCGREGFRERBB2GLP1RESRRG
SCHEMBL4087042 0.86 GCGR (0.63) GCGRGLP1RGIPR
SCHEMBL2662984 0.84 GCGR (0.54) GCGRGLP1RGIPR
SCHEMBL4096239 0.81 HDAC1 (0.50) GCGRGLP1RGIPR
SCHEMBL2663053 0.80 TRPV1 (0.62) GCGRGLP1RGIPR
SCHEMBL2663163 0.79 GCGR (0.66) GCGRGLP1RGIPRESRRG
SCHEMBL2662956 0.78 GCGR (0.61) GCGREGFRERBB2GLP1RESRRG
SCHEMBL2663036 0.78 GCGR (0.53) GCGRGLP1RGIPRCA1CA2
SCHEMBL4091217 0.76 SMN1; SMN2 (0.52) GCGRGLP1RGIPR
SCHEMBL2662978 0.76 GCGR (0.65) GCGRGLP1RGIPR

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-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed