SCHEMBL28567487

SCHEMBL28567487

[CH2]CS(=O)(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.37
CA1 P00915 2/20 0.34
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34
MMP8 P22894 2/20 0.34
MMP13 P45452 2/20 0.34
F2 P00734 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
THRB P10828 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
SCHEMBL4288510 0.78 CA2 (0.30) CA2
SCHEMBL29979617 0.78 CA2 (0.39) CA2CA1MMP1MMP2MMP9
SCHEMBL30818537 0.74 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL4158953 0.74 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL8647396 0.74 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL8648820 0.74 CA2 (0.40) CA2CA1MMP1MMP2MMP9
SCHEMBL11083624 0.73 CA2 (0.36) CA2CA1MMP1MMP2MMP9
SCHEMBL8848684 0.73 CA2 (0.37) CA2CA1MMP1MMP2MMP9
SCHEMBL778582 0.71 CA2 (0.38) CA2CA1MMP1MMP2MMP9
SCHEMBL713096 0.69 LMNA (0.38) THRB

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
CN-107591085-B Window, display device comprising same and manufacturing method of window 三星显示有限公司 2021-05-25 CN disclosed