SCHEMBL7223370

SCHEMBL7223370

COC(=O)C(CCN1C(=O)c2ccccc2C1=O)CS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 19/20 0.56
MMP9 P14780 19/20 0.56
MMP1 P03956 5/20 0.53
MMP3 P08254 4/20 0.53
MMP13 P45452 4/20 0.53
MMP14 P50281 4/20 0.47
ADAM17 P78536 3/20 0.45
ADAM10 O14672 1/20 0.42

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
SCHEMBL7226591 0.88 MMP2 (0.60) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7230600 0.86 MMP2 (0.65) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7077886 0.81 MMP2 (0.66) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7231569 0.79 MMP2 (0.53) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7077896 0.75 MMP2 (0.60) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7810615 0.72 GAA (0.52) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6719170 0.72 MMP2 (0.61) MMP2MMP9MMP1MMP3MMP13
SCHEMBL18451265 0.71 GAA (0.48) MMP2MMP9MMP1MMP3MMP13
SCHEMBL18562888 0.71 GAA (0.48) MMP2MMP9
SCHEMBL6578094 0.70 MMP2 (0.65) MMP2MMP9MMP1MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605604-B1 Tumour necrosis factor alpha release inhibitors; efficiency treatment of cancers, rheumatic diseases, arthritis, ulcers, atherosclerosis, asthma LES LABORATOIRES SERVIER (FR) 2003-08-12 US disclosed