SCHEMBL19042199

SCHEMBL19042199

O=S(=O)(NCCCO)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.46
CA2 P00918 12/20 0.46
MMP1 P03956 6/20 0.46
MMP2 P08253 6/20 0.46
MMP9 P14780 6/20 0.46
MMP8 P22894 6/20 0.46
MMP13 P45452 6/20 0.46
EPHX1 P07099 1/20 0.39
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL19042201 0.94 CA2 (0.53) CA1CA2MMP1MMP2MMP9
SCHEMBL6260406 0.93 CA2 (0.53) CA1CA2MMP1MMP2MMP9
SCHEMBL7881220 0.89 CA2 (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL19042198 0.88 CA2 (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL19042210 0.88 EPHX1 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL7884131 0.86 CA2 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL7887472 0.86 CA2 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL1070262 0.82 CA2 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL1851655 0.81 CA2 (0.57) CA1CA2MMP1MMP2MMP9
SCHEMBL28375339 0.81 CA2 (0.57) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230359119-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-09 US disclosed
US-20170184964-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed
US-20170184962-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed
US-20170184963-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed