SCHEMBL5280430

SCHEMBL5280430

CCc1nnn(C)c1CC(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

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
MAOB P27338 1/20 0.33
GABRB3 P28472 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30

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
SCHEMBL5281697 0.88 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5281528 0.85 MAOB (0.37) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5286967 0.84 GRIA1 (0.34) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5278035 0.82 MAOB (0.44) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5284450 0.81 GABRB3 (0.38) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5284922 0.79 GRIA1 (0.32) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5277274 0.79 GRIA4 (0.41) GRIA4
SCHEMBL5277075 0.78
SCHEMBL5279469 0.78 GRIA1 (0.38) GRIA1GRIA2GRIA3GRIA4
SCHEMBL25609060 0.78

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