SCHEMBL2662809

SCHEMBL2662809

O=C(N/N=C/c1ccc2c(ccn2Cc2cccc(C(F)(F)F)c2)c1)c1ccc(O)c(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADCYAP1R1 P41586 10/20 0.73
GCGR P47871 9/20 0.73
KDM4E B2RXH2 1/20 0.48
MAPT P10636 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
SCHEMBL2662820 0.90 ADCYAP1R1 (0.60) ADCYAP1R1GCGRKDM4EMAPT
SCHEMBL9071579 0.86 GCGR (0.72) ADCYAP1R1GCGR
SCHEMBL9071586 0.86 GCGR (0.76) ADCYAP1R1GCGR
SCHEMBL9071670 0.85 ADCYAP1R1 (1.00) ADCYAP1R1GCGR
SCHEMBL9071689 0.85 GCGR (1.00) ADCYAP1R1GCGR
SCHEMBL9071587 0.83 GCGR (0.72) ADCYAP1R1GCGR
SCHEMBL9071585 0.83 GCGR (0.67) ADCYAP1R1GCGRKDM4E
SCHEMBL9071584 0.82 GCGR (0.73) ADCYAP1R1GCGR
SCHEMBL2662672 0.81 GCGR (0.69) ADCYAP1R1GCGR
SCHEMBL9071582 0.81 GCGR (0.66) ADCYAP1R1GCGRKDM4EMAPT

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-2000039088-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-07-06 WO disclosed