SCHEMBL5280201

SCHEMBL5280201

CCc1c(C(Cl)(Cl)Cl)nnn1CC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
SLC9A1 P19634 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL5273731 0.87 GRIA1 (0.30) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5275986 0.85 SLC9A1 (0.36) GRIA4SLC9A1
SCHEMBL5286771 0.85 GRIA1 (0.31) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5279254 0.85 GRIA1 (0.31) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5277307 0.82 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5277710 0.82 MAOB (0.33)
SCHEMBL5282856 0.82 SLC9A1 (0.39) SLC9A1
SCHEMBL5284199 0.82 SLC9A1 (0.33) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5286431 0.80 GABRB3 (0.34) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5276941 0.79 SLC9A1 (0.34) SLC9A1NPC1

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