SCHEMBL8263276

SCHEMBL8263276

C[C@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1Cc2ccc(C(C)(F)F)nc2C1)C(C)(F)F

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.79
SLC6A5 Q9Y345 3/20 0.62

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
SCHEMBL3872901 0.88 SLC6A9 (1.00) SLC6A9SLC6A5
SCHEMBL3872720 0.86 SLC6A9 (0.86) SLC6A9SLC6A5
SCHEMBL3872141 0.85 SLC6A9 (0.83) SLC6A9SLC6A5
SCHEMBL8262322 0.85 SLC6A9 (0.83) SLC6A9SLC6A5
SCHEMBL8262828 0.84 SLC6A9 (0.73) SLC6A9SLC6A5
SCHEMBL3872551 0.81 SLC6A9 (0.77) SLC6A9SLC6A5
SCHEMBL3872355 0.81 SLC6A9 (0.77) SLC6A9SLC6A5
SCHEMBL3939739 0.81 SLC6A9 (0.75) SLC6A9SLC6A5
SCHEMBL3939736 0.81 SLC6A9 (0.75) SLC6A9SLC6A5
SCHEMBL3885019 0.80 SLC6A9 (0.85) SLC6A9SLC6A5

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-2006082001-A1 HETEROCYCLIC SUBSTITUTED PHENYL METHANONES AS INHIBITORS OF THE GLYCINE TRANSPORTER 1 F.HOFFMANN-LA ROCHE AG (CH) 2006-08-10 WO disclosed