SCHEMBL6864328

SCHEMBL6864328

CC#CCOc1ccc(S(=O)(=O)NC(CCCNC(=O)c2ccncc2)C(=O)NO)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 17/20 0.59
▸ MMP9 P14780 15/20 0.59
▸ MMP1 P03956 12/20 0.59
▸ ADAM10 O14672 7/20 0.59
▸ MMP14 P50281 6/20 0.59
▸ MMP2 P08253 6/20 0.59
▸ MMP13 P45452 9/20 0.57
▸ ADAM8 P78325 4/20 0.55
▸ MMP12 P39900 3/20 0.55
▸ MMP7 P09237 1/20 0.55
▸ MMP8 P22894 1/20 0.55
▸ ADAMTS4 O75173 1/20 0.53
▸ ADAMTS1 Q9UHI8 1/20 0.53
▸ ADAMTS7 Q9UKP4 1/20 0.53
▸ ADAMTS5 Q9UNA0 1/20 0.53
▸ BMP1 P13497 2/20 0.48

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
SCHEMBL3940966 1.00 ADAM17 (0.59) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3939484 0.97 ADAM17 (0.58) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL7419812 0.97 ADAM17 (0.58) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL7425442 0.91 ADAM17 (0.68) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3944287 0.91 ADAM17 (0.68) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL7421462 0.90 ADAM17 (0.61) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3947078 0.90 ADAM17 (0.61) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3949062 0.90 ADAM17 (0.60) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3942829 0.90 ADAM17 (0.64) ADAM17MMP9MMP1ADAM10MMP14
SCHEMBL3944147 0.90 ADAM17 (0.59) ADAM17MMP9MMP1ADAM10MMP14

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-6716833-B2 RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, SEPSIS, AIDS, ULCERATIVE COLITIS, MULTIPLE SCLEROSIS, CROHN'S DISEASE AND DEGENERATIVE CARTILAGE LOSS. WYETH HOLDINGS CORPORATION 2004-04-06 — — US claimed
EP-1144368-A2 ACETYLENIC ALPHA-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-17 — — EP claimed
WO-2000044709-A2 ACETYLENIC α-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 — — WO claimed
WO-2002083112-A2 METHOD FOR THE TREATMENT OF POLYCYSTIC KIDNEY DISEASE WYETH HOLDINGS CORPORATION (US) 2002-10-24 — — WO disclosed
EP-1144368-A2 ACETYLENIC ALPHA-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-17 — — EP disclosed
WO-2000044709-A2 ACETYLENIC α-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 — — WO disclosed
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