SCHEMBL8091798

SCHEMBL8091798

CC1CCC(C)([C@H](NC(=O)c2ccccc2C(F)(F)F)c2ccccc2)N(C)C1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 19/20 0.57

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
SCHEMBL13970171 0.93 SLC6A9 (0.56) SLC6A9
SCHEMBL8088699 0.93 SLC6A9 (0.56) SLC6A9
SCHEMBL13970066 0.92 SLC6A9 (0.69) SLC6A9
SCHEMBL13970173 0.92 SLC6A9 (0.69) SLC6A9
SCHEMBL8085384 0.92 SLC6A9 (0.69) SLC6A9
SCHEMBL13970180 0.90 SLC6A9 (0.49) SLC6A9
SCHEMBL13970109 0.87 SLC6A9 (0.49) SLC6A9
SCHEMBL13970248 0.85 SLC6A9 (0.53) SLC6A9
SCHEMBL8086589 0.85 SLC6A9 (0.52) SLC6A9
SCHEMBL8086612 0.83 SLC6A9 (0.55) SLC6A9

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-2009013535-A1 2-AZABICYCLO(2.2.2)OCTANE DERIVATIVES AS MODULATORS OF THE GLYCINE TRANSPORTER I RECEPTOR ASTRAZENECA AB (SE) 2009-01-29 WO disclosed