SCHEMBL9072191

SCHEMBL9072191

COc1cc(/C=N/NC(=O)c2ccc(O)c(Cl)c2)cc(-c2ccccc2)c1OCCN1CCc2ccccc2C1

nearest known ligand 0.85

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 10/20 0.85
ADCYAP1R1 P41586 6/20 0.58
OPRM1 P35372 1/20 0.50
POLB P06746 3/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
ASF1A Q9Y294 1/20 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
SCHEMBL2663669 0.95 GCGR (0.77) GCGRADCYAP1R1POLBMAPTMEN1
SCHEMBL9072184 0.92 GCGR (1.00) GCGRADCYAP1R1OPRM1POLBMAPT
SCHEMBL2664214 0.85 GCGR (0.63) GCGRADCYAP1R1POLBMAPTKMT2A
SCHEMBL9072102 0.85 GCGR (0.62) GCGRADCYAP1R1MEN1KMT2AALDH1A1
SCHEMBL2663663 0.85 GCGR (0.62) GCGRADCYAP1R1POLBMAPTKMT2A
SCHEMBL2663670 0.84 GCGR (0.61) GCGRADCYAP1R1POLBMAPTMEN1
SCHEMBL2664215 0.84 GCGR (0.61) GCGRADCYAP1R1POLBMAPTMEN1
SCHEMBL2664211 0.80 GCGR (0.55) GCGRADCYAP1R1POLBMAPTMEN1
SCHEMBL9072180 0.80 GCGR (0.77) GCGROPRM1
SCHEMBL2664210 0.79 GCGR (0.62) GCGRADCYAP1R1POLBMAPTMEN1

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-1999001423-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 1999-01-14 WO disclosed