SCHEMBL5281085

SCHEMBL5281085

CCCCCCn1nnc(C(F)(F)C(F)(F)F)c1C(Cl)(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.38
HCAR3 P49019 1/20 0.31
SMPD1 P17405 4/20 0.30
MAPT P10636 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
SCHEMBL5290962 0.94 SLC9A1 (0.36) SLC9A1HCAR3
SCHEMBL5281787 0.90 SLC9A1 (0.41) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5277940 0.89 SLC9A1 (0.37) SLC9A1
SCHEMBL5273917 0.89 SLC9A1 (0.38) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5280303 0.88 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5281103 0.88 SLC9A1 (0.33) SLC9A1
SCHEMBL5284251 0.87 SLC9A1 (0.39) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5280258 0.86 SLC9A1 (0.43) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5285231 0.84 SLC9A1 (0.41) SLC9A1HCAR3SMPD1MAPT
SCHEMBL5278746 0.84 SLC9A1 (0.41) SLC9A1HCAR3SMPD1MAPT

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