SCHEMBL5282043

SCHEMBL5282043

CCn1nnc(C(F)(F)F)c1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.31
NPC1 O15118 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
SCHEMBL5285133 0.86
SCHEMBL5278726 0.86 SLC9A1 (0.34) SLC9A1
SCHEMBL5280913 0.83 SLC9A1 (0.32) SLC9A1NPC1
SCHEMBL5277620 0.83 SLC9A1 (0.37) SLC9A1
SCHEMBL5281693 0.81 SLC9A1 (0.31) SLC9A1NPC1
SCHEMBL5276454 0.80 SLC9A1 (0.40) SLC9A1
SCHEMBL5282869 0.79
SCHEMBL5279102 0.75 GRIA1 (0.36)
SCHEMBL5279683 0.75 ALDH1A1 (0.32)
SCHEMBL5273556 0.75 SLC9A1 (0.33) 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