SCHEMBL7764828

SCHEMBL7764828

NC(=O)c1ccccc1S(=O)(=O)N1CCC(Oc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 7/20 0.78
MMP2 P08253 6/20 0.78
FPR2 P25090 1/20 0.54
PROKR1 Q8TCW9 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.48
MMP12 P39900 1/20 0.47
LIPE Q05469 1/20 0.47
EPHX2 P34913 1/20 0.47
TP53 P04637 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ACLY P53396 1/20 0.46
MAPT P10636 2/20 0.46
TEAD1 P28347 1/20 0.43

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
SCHEMBL5898960 0.88 MMP13 (1.00) MMP13MMP2FPR2PROKR1MMP12
SCHEMBL8361681 0.86 MMP13 (0.78) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL5898984 0.82 MMP13 (1.00) MMP13MMP2FPR2PROKR1MMP12
SCHEMBL5898947 0.78 MMP13 (0.70) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL7414533 0.77 MMP13 (0.56) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL5898977 0.77 MMP13 (1.00) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL5898973 0.77 MMP13 (1.00) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL5898969 0.77 MMP13 (0.82) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL8361683 0.77 MMP13 (0.76) MMP13MMP2FPR2PROKR1SMN1; SMN2
SCHEMBL7076681 0.76 ACLY (0.60) MMP13MMP2FPR2PROKR1SMN1; SMN2

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
WO-2001085680-A2 SULFONYL ARYL OR HETEROARYL HYDROXAMIC ACID COMPOUNDS PHARMACIA CORPORATION (US) 2001-11-15 WO disclosed