SCHEMBL21657764

SCHEMBL21657764

C=CC(=O)OCCNc1nc(NCCCN(CC)CC)nc(Nc2ccc(/N=N/C(C(C)=O)C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)cc2)n1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.33
MAPT P10636 3/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
IGF1R P08069 3/20 0.31
FGFR1 P11362 1/20 0.30
SRC P12931 1/20 0.30
ALDH1A1 P00352 2/20 0.30
GAA P10253 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
SCHEMBL21657897 0.92 MAPT (0.32) JAK3MAPTCA1CA2CA9
SCHEMBL12014060 0.91 CA1 (0.37) MAPTCA1CA2CA9IGF1R
SCHEMBL12667015 0.91 CA1 (0.37) MAPTCA1CA2CA9IGF1R
SCHEMBL12855865 0.89 CA1 (0.35) MAPTCA1CA2CA9IGF1R
SCHEMBL17760937 0.89 CA1 (0.35) MAPTCA1CA2CA9IGF1R
SCHEMBL14017928 0.87 CA1 (0.38) MAPTCA1CA2CA9IGF1R
SCHEMBL14017927 0.87 CA1 (0.35) JAK3MAPTCA1CA2CA9
SCHEMBL12961111 0.86 MAPT (0.35) MAPTCA1CA2CA9ALDH1A1
SCHEMBL21657761 0.85 CA1 (0.38) JAK3MAPTCA1CA2CA9
SCHEMBL19817610 0.85 CA1 (0.34) JAK3MAPTCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11518827-B2 Curable composition, method for producing curable composition, film, color filter, method for manufacturing color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2022-12-06 US disclosed
US-20210122850-A1 CURABLE COMPOSITION, METHOD FOR PRODUCING CURABLE COMPOSITION, FILM, COLOR FILTER, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2021-04-29 US disclosed
WO-2020022247-A1 CURABLE COMPOSITION, PRODUCTION METHOD FOR CURABLE COMPOSITION, FILM, COLOR FILTER, PRODUCTION METHOD FOR COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE 富士フイルム株式会社 2020-01-30 WO disclosed