SCHEMBL5280415

SCHEMBL5280415

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

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
GRIA4 P48058 1/20 0.32
SLC9A1 P19634 1/20 0.32
NPC1 O15118 1/20 0.31
TOP2A P11388 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
SCHEMBL5279099 0.85 SLC9A1 (0.35) GRIA4SLC9A1TOP2A
SCHEMBL5284211 0.82 SLC9A1 (0.38) SLC9A1TOP2A
SCHEMBL5277299 0.80 SLC9A1 (0.41) SLC9A1TOP2A
SCHEMBL5277252 0.79 SLC9A1 (0.35) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5283618 0.78 GRIA1 (0.33) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5278979 0.78 GRIA1 (0.33) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5281737 0.78 GRIA1 (0.30) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5281013 0.77 GABRB3 (0.33) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5285018 0.77 GRIA1 (0.32) GRIA1GRIA2GRIA3GRIA4SLC9A1
SCHEMBL5279319 0.77 GRM2 (0.35) GRIA1GRIA2GRIA3GRIA4SLC9A1

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