SCHEMBL5279002

SCHEMBL5279002

CCn1nnc(C(F)(F)C(F)(F)F)c1CC(C)C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34

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
SCHEMBL5281336 0.88 GRIA4 (0.37) GRIA4
SCHEMBL5279102 0.87 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5278461 0.85 SLC9A1 (0.34) GRIA4
SCHEMBL5275032 0.83 GRIA1 (0.31) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5274673 0.83 SLC9A1 (0.37)
SCHEMBL5282933 0.81 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5277787 0.80 GABRB3 (0.32)
SCHEMBL5277307 0.80 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5279061 0.80 GRIA1 (0.31) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5279400 0.79

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