SCHEMBL20141827

SCHEMBL20141827

N=C[S+]([O-])c1ccccc1F

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.36
NFE2L2 Q16236 1/20 0.34

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
SCHEMBL514390 0.77 ACHE (0.42) ACHENFE2L2
SCHEMBL775875 0.74 ACHE (0.43) ACHENFE2L2
SCHEMBL29403451 0.71 ACHE (0.46) ACHENFE2L2
SCHEMBL31005130 0.70 ACHE (0.50) ACHENFE2L2
SCHEMBL3207396 0.70 ACHE (0.50) ACHENFE2L2
SCHEMBL18195202 0.70 ACHE (0.40) ACHENFE2L2
SCHEMBL2460604 0.70 ACHE (0.40) ACHENFE2L2
SCHEMBL777552 0.67 ACHE (0.37) ACHENFE2L2
SCHEMBL777872 0.67 ACHE (0.37) ACHENFE2L2
SCHEMBL28829403 0.67 ACHE (0.37) ACHENFE2L2

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
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed