SCHEMBL7572011

SCHEMBL7572011

CCC1c2nc[nH]c2CCN1C(=O)OC(=O)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.43
P2RX7 Q99572 1/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL7530146 0.86 AOC3 (0.45) AOC3P2RX7DPP4DPP8DPP9
Trifluoroacetic Acid SCHEMBL7526771 0.81 AOC3 (0.41) AOC3
SCHEMBL7527633 0.80 AOC3 (0.48) AOC3
Trifluoroacetic Acid SCHEMBL7529674 0.80 AOC3 (0.54) AOC3
SCHEMBL7534337 0.79 AOC3 (0.56) AOC3
SCHEMBL7570588 0.78 AOC3 (0.46) AOC3P2RX7
SCHEMBL7534329 0.78 AOC3 (0.48) AOC3
Trifluoroacetic Acid SCHEMBL7527035 0.77 AOC3 (0.50) AOC3
SCHEMBL7531140 0.77
SCHEMBL11516165 0.76 AOC3 (0.43) AOC3

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-2002038153-A1 NEW USE OF 4, 5, 6, 7-TETRAHYDROIMIDAZO-[4,5-C]PYRIDINE DERIVATIVES BIOVITRUM AB (SE) 2002-05-16 WO disclosed