SCHEMBL7991334

SCHEMBL7991334

CC(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)(NC(=O)O)OCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.40
MMP13 P45452 6/20 0.40
MMP1 P03956 7/20 0.40
TP53 P04637 1/20 0.40
MMP9 P14780 11/20 0.39
MMP14 P50281 2/20 0.39
MMP3 P08254 2/20 0.38
MMP8 P22894 1/20 0.37
PTGS2 P35354 1/20 0.36

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
SCHEMBL7991332 0.79 MMP9 (0.49) MMP2MMP13MMP1MMP9MMP3
SCHEMBL8005756 0.78 MMP2 (0.50) MMP2MMP13MMP1TP53MMP9
SCHEMBL7998634 0.77 MMP9 (0.46) MMP2MMP13MMP1MMP9MMP14
SCHEMBL7365907 0.72 MMP2 (0.48) MMP2MMP13MMP1TP53MMP9
SCHEMBL7998631 0.69 MMP2 (0.74) MMP2MMP1MMP9
SCHEMBL8001932 0.67 MMP2 (0.52) MMP2MMP13MMP1TP53MMP9
SCHEMBL7593988 0.67 MMP2 (0.44) MMP2MMP13MMP1MMP9MMP14
SCHEMBL8005755 0.64 MMP9 (0.59) MMP2MMP13MMP1MMP9MMP3
SCHEMBL16712121 0.64 PPARG (0.41)
SCHEMBL8000462 0.64 MMP2 (0.52) MMP2MMP13MMP1MMP9MMP14

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
US-6294573-B1 FOR THERAPY RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPENIAS SUCH AS OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL, EPIDERMAL OR GASTRIC ULCERATION, AND TUMOR GROWTH AND METASTASIS OR INVASION ABBOTT LABORATORIES 2001-09-25 US claimed