SCHEMBL5281061

SCHEMBL5281061

CCCCc1c(C(F)(F)C(F)(F)F)nnn1CCC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.32
SLC9A1 P19634 2/20 0.32
MAOB P27338 1/20 0.31

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
SCHEMBL5287091 0.94 SLC9A1 (0.36) SLC9A1MAOB
SCHEMBL5278108 0.91 SLC9A1 (0.39) SLC9A1
SCHEMBL5286913 0.90 SLC9A1 (0.33) GRIA4SLC9A1
SCHEMBL5286391 0.89 GABRA2 (0.30)
SCHEMBL5275318 0.89 SLC9A1 (0.34) GRIA4SLC9A1MAOB
SCHEMBL5273813 0.88 SLC9A1 (0.36) SLC9A1
SCHEMBL5285653 0.85 SLC9A1 (0.34) GRIA4SLC9A1
SCHEMBL5277160 0.85 SLC9A1 (0.39) SLC9A1
SCHEMBL5274966 0.84 MAOB (0.40) MAOB
SCHEMBL5279353 0.83 SLC9A1 (0.37) SLC9A1

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
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed