SCHEMBL7224797

SCHEMBL7224797

COC(=O)C1CN(C(=O)c2ccc(F)cc2Cl)c2ccccc2CN1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 17/20 0.59
MMP13 P45452 17/20 0.59
ADAM17 P78536 17/20 0.59
MMP9 P14780 16/20 0.59
AVPR2 P30518 2/20 0.43
AVPR1A P37288 2/20 0.43
OXTR P30559 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL6609480 0.93 MMP1 (0.69) MMP1MMP13ADAM17MMP9MAPT
SCHEMBL6612830 0.92 MMP1 (0.53) MMP1MMP13ADAM17MMP9MAPT
SCHEMBL6607945 0.90 MMP1 (0.54) MMP1MMP13ADAM17MMP9AVPR2
SCHEMBL6614506 0.90 MMP1 (0.54) MMP1MMP13ADAM17MMP9
SCHEMBL6610535 0.89 MMP1 (0.73) MMP1MMP13ADAM17MMP9AVPR2
SCHEMBL6611911 0.89 MMP1 (0.57) MMP1MMP13ADAM17MMP9
SCHEMBL6611079 0.87 MMP1 (0.53) MMP1MMP13ADAM17MMP9MAPT
SCHEMBL6610383 0.87 MMP13 (0.56) MMP1MMP13ADAM17MMP9
SCHEMBL6610057 0.86 MMP1 (0.55) MMP1MMP13ADAM17MMP9
SCHEMBL6608690 0.86 MMP1 (0.51) 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