SCHEMBL11273159

SCHEMBL11273159

NCCCNc1c(Cl)cc(C(F)(F)C(O)(F)C(F)(F)F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 5/20 0.32
STK17B O94768 3/20 0.32
KIF11 P52732 1/20 0.32
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30
POLB P06746 1/20 0.30
IDO1 P14902 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
SCHEMBL11273155 0.85 STK17A (0.33) STK17ASTK17BBCHEACHEPOLB
SCHEMBL11272367 0.84 MEN1 (0.33) STK17APOLBIDO1
SCHEMBL11279682 0.79 THRB (0.36)
SCHEMBL11262905 0.77 MEN1 (0.33)
SCHEMBL11268221 0.75 CDC25A (0.33)
SCHEMBL11264841 0.75 KDM4E (0.31)
SCHEMBL11356017 0.71 STK17A (0.33) STK17APOLB
Hydrochloric Acid SCHEMBL28300035 0.70 MRGPRX4 (0.35) POLBIDO1
SCHEMBL11272364 0.69 NR1H2 (0.35) STK17APOLB
Hydrochloric Acid SCHEMBL11266399 0.68 ACHE (0.30) ACHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4322434-A N-Substituted-4-(polyfluoro-2-hydroxy-2-propyl)anilines and compounds related thereto SCHERING CORPORATION (US) 1982-03-30 US disclosed
US-4267193-A N-substituted-4-(polyfluoro-2-hydroxy-2-propyl)anilines and compounds related thereto SCHERING CORPORATION (US) 1981-05-12 US disclosed