SCHEMBL2664045

SCHEMBL2664045

CC1Oc2cc(/C=N/NC(=O)c3ccc(O)c(Cl)c3)cc(/C=C/c3ccccn3)c2O1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.51
POLB P06746 2/20 0.51
KMT2A Q03164 2/20 0.51
GCGR P47871 11/20 0.46
ADCYAP1R1 P41586 2/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
OPRK1 P41145 1/20 0.44
KDM4E B2RXH2 3/20 0.42
HTT P42858 2/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL9072187 0.86 GCGR (0.45) POLBGCGRADCYAP1R1
SCHEMBL2664172 0.85 GCGR (0.46) GCGRADCYAP1R1
SCHEMBL9072413 0.84 GCGR (0.46) GCGRADCYAP1R1
SCHEMBL2664448 0.83 ADCYAP1R1 (0.53) GCGRADCYAP1R1
SCHEMBL9072408 0.83 ADCYAP1R1 (0.44) GCGRADCYAP1R1
SCHEMBL9072175 0.83 GCGR (0.46) GCGRADCYAP1R1
SCHEMBL2664287 0.83 GCGR (0.44) GCGRADCYAP1R1
SCHEMBL9072414 0.83 ADCYAP1R1 (0.48) GCGRADCYAP1R1
SCHEMBL9072172 0.81 ADCYAP1R1 (0.44) GCGRADCYAP1R1
SCHEMBL2664048 0.81 ADCYAP1R1 (0.49) GCGRADCYAP1R1

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