SCHEMBL2664459

SCHEMBL2664459

O=C(N/N=C/c1cccc(/C=C/COc2c(Cl)cccc2Cl)c1)c1ccc(O)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADCYAP1R1 P41586 11/20 0.55
SPHK2 Q9NRA0 1/20 0.51
SPHK1 Q9NYA1 1/20 0.51
GCGR P47871 8/20 0.50

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
SCHEMBL2664645 0.93 ADCYAP1R1 (0.61) ADCYAP1R1GCGR
SCHEMBL2664192 0.89 ADCYAP1R1 (0.64) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664458 0.86 GCGR (0.58) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL9072264 0.85 ADCYAP1R1 (0.55) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL9072262 0.85 GCGR (0.69) GCGR
SCHEMBL2664333 0.84 GCGR (0.56) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664364 0.83 ADCYAP1R1 (0.60) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664199 0.82 ADCYAP1R1 (0.62) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL2664047 0.81 ADCYAP1R1 (0.72) ADCYAP1R1SPHK2SPHK1GCGR
SCHEMBL9072414 0.81 ADCYAP1R1 (0.48) 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