SCHEMBL7765024

SCHEMBL7765024

CC1(C)SCCN(S(=O)(=O)c2ccc(OCc3ccncc3)cc2)[C@@H]1C(=O)NO

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.78
ADAM17 P78536 15/20 0.78
MMP13 P45452 15/20 0.78
MMP3 P08254 7/20 0.78
MMP9 P14780 7/20 0.78
MMP2 P08253 6/20 0.78
MMP7 P09237 5/20 0.78
MMP8 P22894 3/20 0.78
MMP14 P50281 2/20 0.78
ADAM10 O14672 2/20 0.68
ADAM9 Q13443 2/20 0.68

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
SCHEMBL6381652 1.00 MMP1 (0.78) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL7075595 0.91 MMP1 (0.75) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL7055124 0.88 MMP1 (0.73) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL8661132 0.88 MMP1 (0.60) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL7055128 0.88 MMP1 (0.73) MMP1ADAM17MMP13MMP3MMP9
Prinomastat SCHEMBL6801875 0.88 MMP1 (1.00) MMP1ADAM17MMP13MMP3MMP9
Prinomastat SCHEMBL3955053 0.88 MMP1 (1.00) MMP1ADAM17MMP13MMP3MMP9
Prinomastat SCHEMBL115696 0.88 MMP1 (1.00) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL7051193 0.88 MMP1 (0.70) MMP1ADAM17MMP13MMP3MMP9
SCHEMBL7051190 0.88 MMP1 (0.70) MMP1ADAM17MMP13MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP claimed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO claimed
EP-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP disclosed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO disclosed