SCHEMBL7220828

SCHEMBL7220828

COc1ccc(S(=O)(=O)N2CC[C@@H](C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)C[C@@H]2C(=O)NOCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.55
MMP9 P14780 11/20 0.55
MMP3 P08254 11/20 0.55
MMP7 P09237 10/20 0.55
MMP2 P08253 2/20 0.55
MMP8 P22894 2/20 0.55
MMP13 P45452 8/20 0.53
STS P08842 2/20 0.51
ADAM17 P78536 4/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL7220826 1.00 MMP1 (0.55) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7214325 0.85 MMP1 (0.73) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7214322 0.85 MMP1 (0.73) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7214256 0.85 MMP1 (0.60) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7220742 0.85 MMP1 (0.69) MMP1MMP9MMP3MMP7MMP2
SCHEMBL24392103 0.76 STS (0.65) STSKMT2A
SCHEMBL7251082 0.75 MMP1 (0.80) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7059685 0.75 MMP1 (0.49) MMP1MMP9MMP3MMP7MMP2
SCHEMBL7058353 0.74 MMP1 (0.69) MMP1MMP9MMP3MMP7MMP2
Hydrochloric Acid SCHEMBL7220950 0.72 MMP1 (0.74) MMP1MMP9MMP3MMP7MMP2

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 3 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 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