SCHEMBL21667232

SCHEMBL21667232

O=S(=O)(OCCCOS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 16/20 0.50
CA2 P00918 16/20 0.50
CA12 O43570 5/20 0.44
CA7 P43166 5/20 0.44
CA13 Q8N1Q1 3/20 0.44
MMP9 P14780 2/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
CA9 Q16790 8/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
CA3 P07451 3/20 0.32
CA4 P22748 3/20 0.32
CA6 P23280 3/20 0.32

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
SCHEMBL4870631 0.86 RECQL (0.50) CA1CA2CA12CA7CA13
SCHEMBL6115331 0.80 CA1 (0.48) CA1CA2CA12CA7CA13
SCHEMBL947874 0.77 CA1 (0.44) CA1CA2CA12CA7CA13
SCHEMBL12256407 0.76 RECQL (0.49) CA1CA2CA12CA7CA9
SCHEMBL15152528 0.76 CA1 (0.43) CA1CA2CA12CA7CA13
SCHEMBL15701004 0.74 RECQL (0.47) CA1CA2CA12CA7CA9
SCHEMBL15152520 0.74 CA2 (0.42) CA1CA2CA12CA7CA13
SCHEMBL15152530 0.73 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL15152532 0.73 CA1 (0.41) CA1CA2CA12CA7CA13
SCHEMBL15173534 0.71 CA1 (0.41) CA1CA2CA12CA7CA13

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
US-20200040222-A1 COMPOSITION, ADHESIVE FILM, LAMINATE, METHOD FOR PRODUCING CURED PRODUCT PATTERN, AND METHOD FOR MANUFACTURING CIRCUIT SUBSTRATE FUJIFILM CORPORATION (JP) 2020-02-06 US disclosed