SCHEMBL6767808

SCHEMBL6767808

CC(C)(NS(=O)(=O)c1ccc2c3c(oc2c1)CCC3)C(=O)NO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.45
MMP9 P14780 2/20 0.45
MMP13 P45452 2/20 0.45
MMP2 P08253 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
ADAM17 P78536 2/20 0.42
MAPT P10636 6/20 0.40
TP53 P04637 5/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR6 P50406 5/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GLA P06280 2/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL6767630 0.98 MMP1 (0.45) MMP1MMP9MMP13MMP2ALDH1A1
SCHEMBL6773578 0.97 MMP1 (0.44) MMP1MMP9MMP13MMP2ALDH1A1
SCHEMBL6770871 0.97 MMP1 (0.44) MMP1MMP9MMP13MMP2ALDH1A1
SCHEMBL6770618 0.88 ALDH1A1 (0.45) MMP13ALDH1A1KDM4EMAPTTP53
SCHEMBL6772123 0.86 KDM4E (0.45) ALDH1A1KDM4EMAPTTP53SMN1; SMN2
SCHEMBL6778063 0.85 KDM4E (0.44) ALDH1A1KDM4EMAPTTP53SMN1; SMN2
SCHEMBL6767549 0.84 MAPT (0.45) ALDH1A1KDM4EMAPTTP53SMN1; SMN2
SCHEMBL6767876 0.80 ALDH1A1 (0.49) MMP1MMP9MMP13MMP2ALDH1A1
SCHEMBL6577251 0.76 MMP13 (0.52) MMP1MMP9MMP13MMP2ALDH1A1
SCHEMBL6579753 0.76 MMP13 (0.52) MMP1MMP9MMP13MMP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210326-B1 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-25 EP claimed
EP-1210326-A2 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-06-05 EP claimed
WO-2001012592-A2 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-02-22 WO claimed
EP-1210326-B1 HYDROXAMIC ACID COMPOUNDS USEFUL AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-25 EP disclosed
US-6677355-B1 DIBENZOFURAN-3-(SULFONYLAMINO OR SULFINAMINO) DERIVATIVES; MULTIPLE SCLEROSIS, ATHEROSCLEROSIS, HEART FAILURE, PERIODONTAL DISEASE, OSTEOARTHRITIS, AUTOIMMUNE DISEASE; ANTICARCINOGENIC AGENTS WARNER-LAMBERT COMPANY 2004-01-13 US disclosed