SCHEMBL17429348

SCHEMBL17429348

N#COS(=O)(=O)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.51
KMT2A Q03164 1/20 0.47
IDO1 P14902 2/20 0.42
DAO P14920 1/20 0.40
MIF P14174 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
NAMPT P43490 1/20 0.38
NAAA Q02083 1/20 0.38

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
SCHEMBL17429334 0.82 CA12 (0.38) KMT2AIDO1MIFCA1CA2
SCHEMBL17429328 0.79 POLB (0.43) KMT2ACA1CA2CA9BCHE
Hydrochloric Acid SCHEMBL28137731 0.79 KIF11 (0.54) KIF11KMT2AIDO1CA1CA2
SCHEMBL10405155 0.78 KMT2A (0.55) KMT2ACA1CA2CA9
SCHEMBL17429352 0.78 KMT2A (0.63) KIF11KMT2AIDO1DAOCA1
SCHEMBL1958962 0.76 KIF11 (0.51) KIF11KMT2AIDO1DAOMIF
SCHEMBL28620558 0.76 KIF11 (0.51) KIF11KMT2AIDO1CA1CA2
SCHEMBL28750669 0.75 KIF11 (0.50) KIF11KMT2AIDO1CA1CA2
SCHEMBL16140113 0.74 KIF11 (0.61) KIF11KMT2AIDO1CA1CA2
SCHEMBL6244263 0.73 KIF11 (0.49) KIF11KMT2AIDO1BCHEACHE

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-9947965-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2018-04-17 US disclosed
US-20160013517-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-14 US disclosed