SCHEMBL19970067

SCHEMBL19970067

CCCNC(=O)c1ccc(C(CCC)n2ccc3cc(-c4ccc(C(F)(F)F)cc4)ccc32)cc1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCGR P47871 19/20 0.70
CD274 Q9NZQ7 1/20 0.44
GIPR P48546 1/20 0.44

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
SCHEMBL19922820 0.93 GCGR (0.81) GCGRGIPR
SCHEMBL19922841 0.90 GCGR (0.67) GCGRGIPR
SCHEMBL19922788 0.89 GCGR (0.61) GCGR
SCHEMBL19922811 0.87 GCGR (0.78) GCGRGIPR
SCHEMBL19922764 0.86 GCGR (0.77) GCGRGIPR
SCHEMBL19922822 0.85 GCGR (0.86) GCGR
SCHEMBL19922869 0.84 GCGR (0.64) GCGRGIPR
SCHEMBL19922776 0.84 GCGR (0.79) GCGR
SCHEMBL19922818 0.84 GCGR (0.63) GCGRGIPR
SCHEMBL19922855 0.83 GCGR (0.69) GCGR

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-2018048761-A1 INDOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2018-03-15 WO disclosed