SCHEMBL5285544

SCHEMBL5285544

CCCCn1nnc(C(F)(F)C(F)(F)F)c1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.36
GRM2 Q14416 1/20 0.33
TOP2A P11388 1/20 0.31
HCAR3 P49019 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL5284459 0.94 SLC9A1 (0.38) SLC9A1HCAR3
SCHEMBL5286531 0.91 SLC9A1 (0.33) SLC9A1
SCHEMBL5277620 0.88 SLC9A1 (0.37) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5285133 0.84
SCHEMBL5286379 0.83 SLC9A1 (0.38) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5276454 0.82 SLC9A1 (0.40) SLC9A1HCAR3
SCHEMBL5273217 0.81 SLC9A1 (0.37) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5281344 0.80 SLC9A1 (0.36) SLC9A1GRM2TOP2AHCAR3
SCHEMBL5280880 0.80 SLC9A1 (0.38) SLC9A1GRM2TOP2AHCAR3MEN1
SCHEMBL5276723 0.80 SLC9A1 (0.38) SLC9A1GRM2TOP2AHCAR3MEN1

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