SCHEMBL7430258

SCHEMBL7430258

O=C(O)NC1CCCCC1CS(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 14/20 0.52
▸ MMP9 P14780 12/20 0.52
▸ MMP14 P50281 9/20 0.52
▸ MMP3 P08254 5/20 0.41
▸ MMP1 P03956 5/20 0.41
▸ MMP8 P22894 5/20 0.41
▸ MMP7 P09237 3/20 0.41
▸ ADAM17 P78536 2/20 0.41
▸ MMP13 P45452 3/20 0.41
▸ ENPP3 O14638 1/20 0.41
▸ ENPP1 P22413 1/20 0.41
▸ ENPP2 Q13822 1/20 0.41

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
SCHEMBL22090368 0.75 LMNA (0.48) —
SCHEMBL7430251 0.75 MMP2 (0.50) MMP2MMP9MMP14MMP3MMP1
SCHEMBL7916925 0.75 MMP2 (0.50) MMP2MMP9MMP14MMP3MMP1
SCHEMBL56831 0.74 MMP1 (0.51) MMP2MMP9MMP14MMP3MMP1
SCHEMBL7924914 0.74 CRBN (0.47) MMP2MMP9MMP14MMP1MMP8
SCHEMBL20959508 0.71 EPHX2 (0.50) —
SCHEMBL21820745 0.69 CRBN (0.53) MMP2MMP9MMP14
SCHEMBL27543888 0.67 BCL2L1 (0.51) MMP2MMP9MMP14MMP3MMP1
SCHEMBL2986117 0.67 CCR2 (0.62) —
SCHEMBL4613043 0.67 CTSK (0.77) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 — — US claimed
WO-2000044712-A1 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-08-03 — — WO claimed
US-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 — — US disclosed
WO-2000044712-A1 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-08-03 — — WO disclosed
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