SCHEMBL14419962

SCHEMBL14419962

CS(=O)(=O)Nc1cccc(N[SH](=O)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
POLB P06746 1/20 0.50
KIF11 P52732 1/20 0.46
NR3C1 P04150 1/20 0.45
BRD4 O60885 2/20 0.44
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
HTT P42858 1/20 0.43
DHX9 Q08211 1/20 0.43
NPC1 O15118 1/20 0.42
JAK2 O60674 1/20 0.42
RAB9A P51151 1/20 0.42
KDM1A O60341 1/20 0.42
NR3C2 P08235 1/20 0.42

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
SCHEMBL698855 0.86 KEAP1 (0.70) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL14356798 0.80 KEAP1 (0.56) KEAP1ALDH1A1SMN1; SMN2KIF11HTT
SCHEMBL1488105 0.79 KEAP1 (0.59) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL29794800 0.78 KEAP1 (0.53) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL14534697 0.78 TNNI3K (0.46) ALDH1A1SMN1; SMN2JAK2
SCHEMBL1488101 0.77 KEAP1 (0.57) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL9781874 0.75 ALDH1A1 (0.50) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL169803 0.75 KEAP1 (0.59) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL9865360 0.75 KEAP1 (0.59) KEAP1ALDH1A1SMN1; SMN2POLBKIF11
SCHEMBL9307018 0.75 KEAP1 (0.59) KEAP1ALDH1A1SMN1; SMN2POLBKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140176653-A1 NOVEL COMPOUND HAVING MULTIMER STRUCTURE OF XANTHENE DERIVATIVE, COLORING COMPOSITION, INK FOR INKJET RECORDING, METHOD OF INKJET RECORDING, COLOR FILTER, AND COLOR TONER FUJIFILM CORPORATION (JP) 2014-06-26 US disclosed
US-7270703-B2 Metallized dyes having colorfastness, heat and ozone resistance, used for thermal printing, color filters, toners, liquid crystal displays and coloring fibers FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-7256222-B2 Radiation-curable ink composition and image recording method FUJIFILM CORPORATION (JP) 2007-08-14 US disclosed
US-7250079-B2 Coloring composition and inkjet recording method FUJIFILM CORPORATION (JP) 2007-07-31 US disclosed
US-7223453-B2 Ink jet recording medium and ink jet recording method FUJIFILM CORPORATION (JP) 2007-05-29 US disclosed
US-7219988-B2 Water-soluble phthalocyanine compound-containing ink for ink jetting, ink jet recording method and method for improving ozone gas discoloration of colored image material FUJI PHOTO FILM CO., LTD. (JP) 2007-05-22 US disclosed