SCHEMBL7423765

SCHEMBL7423765

CC#CCOc1ccc(S(=O)(=O)C2(C(=O)ONCc3ccccc3)CCNCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 18/20 0.67
MMP13 P45452 13/20 0.67
MMP1 P03956 7/20 0.56
MMP9 P14780 6/20 0.56
MMP2 P08253 3/20 0.52
MMP3 P08254 1/20 0.48
MMP10 P09238 1/20 0.48
MMP14 P50281 2/20 0.46

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
SCHEMBL6264143 0.85 ADAM17 (0.78) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7427544 0.83 ADAM17 (0.60) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6268536 0.80 ADAM17 (1.00) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7428773 0.80 ADAM17 (0.64) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7421888 0.80 ADAM17 (0.58) ADAM17MMP13MMP1MMP9MMP2
Hydrochloric Acid SCHEMBL3947782 0.79 ADAM17 (0.98) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7423131 0.78 ADAM17 (0.53) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6870501 0.77 ADAM17 (0.56) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7437127 0.76 ADAM17 (0.67) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7365055 0.76 ADAM17 (0.70) ADAM17MMP13MMP1MMP9MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147085-A1 ALKYNYL CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS / TNF-ALPHA CONVERTING ENZYME (TACE) INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044723-A1 ALKYNYL CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS/TNF-ALPHA CONVERTING ENZYME (TACE) INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed