SCHEMBL5285646

SCHEMBL5285646

CCCCn1nnc(C(Cl)(Cl)Cl)c1C(Cl)(Cl)C(Cl)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.37
GRM2 Q14416 1/20 0.34
TOP2A P11388 1/20 0.33
HCAR3 P49019 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
SCHEMBL5275517 0.94 SLC9A1 (0.40) SLC9A1GRM2HCAR3
SCHEMBL5276092 0.92 SLC9A1 (0.38) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5277843 0.90 SLC9A1 (0.34) SLC9A1GRM2
SCHEMBL5282569 0.89 SLC9A1 (0.36) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5279834 0.88 SLC9A1 (0.40) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5280402 0.88 SLC9A1 (0.36) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5279295 0.87 SLC9A1 (0.37) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5278425 0.86 SLC9A1 (0.41) SLC9A1GRM2HCAR3
SCHEMBL5282773 0.85 SLC9A1 (0.38) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5275918 0.85 SLC9A1 (0.34) SLC9A1GRM2TOP2A

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