SCHEMBL5273631

SCHEMBL5273631

CCCCCCn1nnc(C(F)(F)C(F)(F)F)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.38
HCAR3 P49019 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
SCHEMBL5275420 0.94 SLC9A1 (0.35) SLC9A1
SCHEMBL5282045 0.89 SLC9A1 (0.39) SLC9A1HCAR3
SCHEMBL5281356 0.88 SLC9A1 (0.32) SLC9A1
SCHEMBL5283287 0.84 SLC9A1 (0.40) SLC9A1HCAR3
SCHEMBL5278728 0.83 SLC9A1 (0.39) SLC9A1HCAR3
SCHEMBL5275219 0.82 SLC9A1 (0.36) SLC9A1HCAR3
SCHEMBL5286808 0.82
SCHEMBL5275053 0.81 SLC9A1 (0.38) SLC9A1HCAR3
SCHEMBL5281787 0.80 SLC9A1 (0.41) SLC9A1HCAR3
SCHEMBL5285231 0.80 SLC9A1 (0.41) SLC9A1HCAR3

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