SCHEMBL5285034

SCHEMBL5285034

CCCCn1nnc(C(Cl)(Cl)C(Cl)(Cl)Cl)c1C#N

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.35
GRM2 Q14416 1/20 0.32
TOP2A P11388 1/20 0.31

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
SCHEMBL5275053 0.94 SLC9A1 (0.38) SLC9A1
SCHEMBL5278614 0.91 SLC9A1 (0.32) SLC9A1
SCHEMBL5278027 0.88 SLC9A1 (0.36) SLC9A1GRM2TOP2A
SCHEMBL5277788 0.84
SCHEMBL5274641 0.83 SLC9A1 (0.37) SLC9A1GRM2TOP2A
SCHEMBL5278728 0.82 SLC9A1 (0.39) SLC9A1
SCHEMBL5275219 0.82 SLC9A1 (0.36) SLC9A1GRM2TOP2A
SCHEMBL5275420 0.79 SLC9A1 (0.35) SLC9A1GRM2TOP2A
SCHEMBL5278355 0.78 SLC9A1 (0.38) SLC9A1GRM2TOP2A
SCHEMBL5278895 0.78 SLC9A1 (0.33) SLC9A1GRM2

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