SCHEMBL5286967

SCHEMBL5286967

CCc1c(CC(C)C)nnn1C

nearest known ligand 0.34

Predicted protein targets (top 6)

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
CACNA2D1 P54289 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
SCHEMBL5278092 0.85 MAOB (0.40) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5280430 0.84 GRIA1 (0.34) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5278361 0.82 MAOB (0.51) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5284450 0.81 GABRB3 (0.38) GRIA1GRIA2GRIA3GRIA4MAOB
SCHEMBL5319341 0.79 GRIA1 (0.32) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5278254 0.79 GRIA4 (0.41) GRIA4
SCHEMBL5272708 0.79 KDM4E (0.33) GRIA1GRIA2GRIA3GRIA4CACNA2D1
SCHEMBL5273224 0.78 GRIA1 (0.38) GRIA1GRIA2GRIA3GRIA4
SCHEMBL5277152 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