SCHEMBL2663181

SCHEMBL2663181

N=NC(=N)NC(=O)c1ccc(CN(C(=O)Nc2ccc(OC(F)(F)F)c(-c3nc4ccccc4o3)c2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCGR P47871 11/20 0.48
GIPR P48546 8/20 0.42
STAT3 P40763 5/20 0.36
P2RY14 Q15391 1/20 0.36
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
THRB P10828 1/20 0.35
S1PR1 P21453 1/20 0.35

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
SCHEMBL6752428 0.87 GCGR (0.66) GCGRGIPR
SCHEMBL4091720 0.87 GCGR (0.52) GCGRGIPR
SCHEMBL2650782 0.83 GCGR (0.59) GCGRGIPR
SCHEMBL2650784 0.82 GCGR (0.52) GCGRGIPR
SCHEMBL2666060 0.76 GCGR (0.58) GCGRGIPR
SCHEMBL2651552 0.74 GCGR (0.66) GCGRGIPRMAPT
SCHEMBL2663464 0.74 GCGR (0.50) GCGRGIPRMAPT
SCHEMBL9071754 0.73 GCGR (0.60) GCGRGIPRMAPT
SCHEMBL2663062 0.73 GCGR (0.69) GCGRGIPRSTAT3
SCHEMBL9072671 0.72 GCGR (0.52) GCGRGIPRSTAT3

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-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed