SCHEMBL7230600

SCHEMBL7230600

O=C(NO)C(CCN1C(=O)c2ccccc2C1=O)CS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 17/20 0.65
MMP9 P14780 17/20 0.65
MMP1 P03956 6/20 0.65
MMP3 P08254 5/20 0.65
MMP13 P45452 3/20 0.65
MMP14 P50281 3/20 0.56
ADAM17 P78536 2/20 0.56
MMP8 P22894 3/20 0.51
HDAC1 Q13547 3/20 0.48
HDAC7 Q8WUI4 3/20 0.48

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 0.89 MMP2 (0.60) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7223370 0.86 MMP2 (0.56) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6580404 0.83 MMP2 (0.67) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7230732 0.79 MMP2 (0.66) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7222497 0.77 MMP2 (0.64) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7077886 0.76 MMP2 (0.66) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7224858 0.75 MMP2 (0.70) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7945656 0.75 MMP2 (0.77) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7224278 0.75 MMP2 (0.61) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6383136 0.73 MMP2 (0.60) 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