SCHEMBL2664046

SCHEMBL2664046

CCN(CC)C/C=C/c1ccc(/C=N/NC(=O)c2ccc(O)c(Cl)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADCYAP1R1 P41586 4/20 0.55
GCGR P47871 14/20 0.54
ESRRG P62508 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL2664196 0.85 ADCYAP1R1 (0.61) ADCYAP1R1GCGRESRRG
SCHEMBL9072415 0.84 ADCYAP1R1 (0.60) ADCYAP1R1GCGRESRRG
SCHEMBL2664186 0.83 GCGR (0.69) GCGR
SCHEMBL2664201 0.83 ADCYAP1R1 (0.59) ADCYAP1R1GCGRESRRG
SCHEMBL9072416 0.82 ADCYAP1R1 (0.62) ADCYAP1R1GCGRMEN1KMT2A
SCHEMBL2664663 0.82 GCGR (0.55) ADCYAP1R1GCGRESRRG
SCHEMBL9072402 0.81 ADCYAP1R1 (0.61) ADCYAP1R1GCGRESRRGKDM4EALDH1A1
SCHEMBL2664437 0.81 ADCYAP1R1 (0.55) ADCYAP1R1GCGRESRRGKDM4EMEN1
SCHEMBL2664472 0.78 ADCYAP1R1 (0.56) ADCYAP1R1GCGRESRRG
SCHEMBL2664654 0.78 GCGR (0.60) ADCYAP1R1GCGRESRRGMAPT

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