SCHEMBL7422265

SCHEMBL7422265

COc1ccc(S(=O)(=O)N2Cc3ccccc3N(C(=O)CN3CCN(C)CC3)CC2C(=O)O)cc1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.83
MMP13 P45452 18/20 0.83
ADAM17 P78536 17/20 0.83
MMP9 P14780 17/20 0.83
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MMP3 P08254 1/20 0.47
MMP7 P09237 1/20 0.47
TAS2R14 Q9NYV8 1/20 0.47

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
SCHEMBL6608123 0.94 MMP1 (0.73) MMP1MMP13ADAM17MMP9MEN1
SCHEMBL6610939 0.92 MMP1 (0.84) MMP1MMP13ADAM17MMP9MEN1
Potassium Ion SCHEMBL6613608 0.92 MMP1 (0.81) MMP1MMP13ADAM17MMP9MEN1
SCHEMBL6612421 0.87 MMP1 (0.68) MMP1MMP13ADAM17MMP9TAS2R14
SCHEMBL6624972 0.86 MMP1 (0.81) MMP1MMP13ADAM17MMP9TAS2R14
SCHEMBL7429606 0.86 MMP1 (0.67) MMP1MMP13ADAM17MMP9
SCHEMBL7427798 0.85 MMP1 (0.70) MMP1MMP13ADAM17MMP9MMP3
SCHEMBL7424100 0.85 MMP1 (0.65) MMP1MMP13ADAM17MMP9TAS2R14
SCHEMBL6610710 0.85 MMP1 (0.69) MMP1MMP13ADAM17MMP9TAS2R14
SCHEMBL6614299 0.84 MMP1 (0.80) MMP1MMP13ADAM17MMP9TAS2R14

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
EP-1051407-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-11-15 EP claimed
US-6071903-A ENZYME INHIBITORS OF MATRIX METALLOPROTEINASES (MMPS); ANTITUMOR,-CARCINOGENIC AND -ARTHRITIC AGENTS; OSTEOARTHRITIS; RHEUMATOID DISEASES; DEGENERATIVE CARTILAGE LOSS; LONG-ACTING, ORALLY BIOAVAILABLE NONPEPTIDE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-06-06 US claimed
WO-1999037625-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-07-29 WO claimed
EP-1051407-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-11-15 EP disclosed
US-6071903-A ENZYME INHIBITORS OF MATRIX METALLOPROTEINASES (MMPS); ANTITUMOR,-CARCINOGENIC AND -ARTHRITIC AGENTS; OSTEOARTHRITIS; RHEUMATOID DISEASES; DEGENERATIVE CARTILAGE LOSS; LONG-ACTING, ORALLY BIOAVAILABLE NONPEPTIDE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-06-06 US disclosed
WO-1999037625-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-07-29 WO disclosed