SCHEMBL2664622

SCHEMBL2664622

COc1cc(/C=N/NC(=O)c2ccc(O)c(Cl)c2)cc(C#CCCO)c1OC

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADCYAP1R1 P41586 7/20 0.62
GCGR P47871 10/20 0.59
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 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
SCHEMBL9072396 0.93 ADCYAP1R1 (0.65) ADCYAP1R1GCGR
SCHEMBL9072168 0.91 ADCYAP1R1 (0.62) ADCYAP1R1GCGRALDH1A1LMNAPOLB
SCHEMBL9072399 0.90 ADCYAP1R1 (0.63) ADCYAP1R1GCGR
SCHEMBL9072167 0.88 ADCYAP1R1 (0.72) ADCYAP1R1GCGRALDH1A1LMNAPOLB
SCHEMBL2664615 0.88 ADCYAP1R1 (0.67) ADCYAP1R1GCGRALDH1A1LMNAPOLB
SCHEMBL2664623 0.86 ADCYAP1R1 (0.59) ADCYAP1R1GCGR
SCHEMBL9072395 0.86 ADCYAP1R1 (0.63) ADCYAP1R1GCGRALDH1A1POLBMAPT
SCHEMBL9072400 0.86 ADCYAP1R1 (0.67) ADCYAP1R1GCGRALDH1A1LMNAPOLB
SCHEMBL9072188 0.85 ADCYAP1R1 (0.60) ADCYAP1R1GCGRALDH1A1LMNAPOLB
SCHEMBL9072170 0.85 ADCYAP1R1 (0.63) ADCYAP1R1GCGR

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