SCHEMBL7222869

SCHEMBL7222869

COC(=O)C1CN(C(=O)CN2CCOCC2)c2ccccc2CN1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 17/20 0.71
MMP13 P45452 16/20 0.71
ADAM17 P78536 16/20 0.71
MMP9 P14780 15/20 0.71
TSHR P16473 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MMP2 P08253 1/20 0.45
MMP3 P08254 1/20 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
SCHEMBL6610939 0.92 MMP1 (0.84) MMP1MMP13ADAM17MMP9MEN1
SCHEMBL6608003 0.87 MMP1 (0.61) MMP1MMP13ADAM17MMP9MMP2
SCHEMBL6614425 0.86 MMP1 (0.73) MMP1MMP13ADAM17MMP9
SCHEMBL6610165 0.86 MMP1 (0.84) MMP1MMP13ADAM17MMP9
SCHEMBL6615265 0.85 MMP1 (0.71) MMP1MMP13ADAM17MMP9MMP2
SCHEMBL6608627 0.85 MMP1 (0.71) MMP1MMP13ADAM17MMP9MAPT
SCHEMBL6608123 0.84 MMP1 (0.73) MMP1MMP13ADAM17MMP9MEN1
SCHEMBL7422265 0.84 MMP1 (0.83) MMP1MMP13ADAM17MMP9MEN1
SCHEMBL6642535 0.84 MMP1 (0.69) MMP1MMP13ADAM17MMP9
SCHEMBL7221772 0.84 MMP1 (0.72) MMP1MMP13ADAM17MMP9

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-6544984-B1 Treating disease conditions mediated by matrix metalloproteinases and TACE, such as tumor growth, osteoarthritis, rheumatoid arthritis and degenerative cartilage loss. AMERICAN CYANAMID COMPANY 2003-04-08 US disclosed
EP-1147095-A1 2, 3, 4, 5-TETRAHYDRO-1H-[1, 4] BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
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
WO-2000044730-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]BENZODIAZEPINE-3-HYDROXAMIC ACID AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO 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