SCHEMBL7220732

SCHEMBL7220732

COC(=O)[C@@H]1CCN(S(=O)(=O)CCCOc2ccc(F)cc2)[C@@H](C(=O)NO)C1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.68
ADAM17 P78536 7/20 0.68
MMP13 P45452 10/20 0.47
MMP8 P22894 1/20 0.47
MMP12 P39900 1/20 0.47
MMP3 P08254 10/20 0.45
MMP7 P09237 8/20 0.45
MMP2 P08253 7/20 0.45

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
SCHEMBL8521305 1.00 MMP1 (0.68) MMP1ADAM17MMP13MMP8MMP12
SCHEMBL7214373 0.90 MMP1 (0.55) MMP1ADAM17MMP13MMP8MMP12
SCHEMBL8521079 0.90 MMP1 (0.55) MMP1ADAM17MMP13MMP8MMP12
SCHEMBL7220248 0.90 ADAM17 (0.55) MMP1ADAM17MMP13MMP8MMP12
SCHEMBL7215199 0.87 ADAM17 (0.52) MMP1ADAM17
SCHEMBL7221238 0.85 ADAM17 (0.57) MMP1ADAM17MMP13MMP8MMP12
SCHEMBL7220119 0.81 MMP1 (1.00) MMP1ADAM17MMP13MMP8MMP3
SCHEMBL7221296 0.81 MMP1 (1.00) MMP1ADAM17MMP13MMP8MMP3
SCHEMBL7220235 0.71 MMP1 (0.83) MMP1ADAM17MMP13MMP8MMP3
SCHEMBL7214512 0.71 MMP1 (0.83) MMP1ADAM17MMP13MMP8MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6599890-B1 Inhibitors of matrix metalloproteinases or the production of tumor necrosis factor PFIZER INC 2003-07-29 US claimed
EP-0960098-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-12-01 EP claimed
WO-1998034918-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-08-13 WO claimed
US-6599890-B1 Inhibitors of matrix metalloproteinases or the production of tumor necrosis factor PFIZER INC 2003-07-29 US disclosed
EP-0960098-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-12-01 EP disclosed
WO-1998034918-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-08-13 WO disclosed