SCHEMBL7316213

SCHEMBL7316213

COc1ccc(S(=O)(=O)CNc2c(CN3CCN(C)CC3)cccc2C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 7/20 0.57
MMP9 P14780 7/20 0.57
MMP13 P45452 7/20 0.57
ADAM17 P78536 7/20 0.57
HTR6 P50406 5/20 0.50
F10 P00742 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL7323224 0.92 MMP1 (0.57) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7316388 0.91 MMP9 (0.67) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7315611 0.83 MMP9 (0.57) MMP1MMP9MMP13ADAM17
SCHEMBL7313714 0.82 MMP1 (0.51) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7325380 0.80 MMP9 (0.68) MMP1MMP9MMP13ADAM17LMNA
SCHEMBL7318156 0.80 MMP1 (0.59) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7320044 0.80 MMP1 (0.60) MMP1MMP9MMP13ADAM17CYP3A4
SCHEMBL7448969 0.80 MMP1 (0.67) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7316221 0.78 MMP1 (0.81) MMP1MMP9MMP13ADAM17HTR6
SCHEMBL7816811 0.78 MMP1 (0.50) MMP1MMP9MMP13ADAM17HTR6

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-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed