SCHEMBL7108169

SCHEMBL7108169

O=C(NO)C(O)(CN1CCOCC1)CS(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.55
MMP13 P45452 13/20 0.55
MMP1 P03956 12/20 0.55
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
MMP3 P08254 2/20 0.47
MMP7 P09237 1/20 0.47
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46

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
SCHEMBL6764638 0.80 MMP13 (0.67) MMP2MMP13MMP1
SCHEMBL7216329 0.77 MMP13 (0.55) MMP2MMP13MMP1MMP3MMP7
SCHEMBL6774922 0.77 MMP13 (0.67) MMP2MMP13MMP1
SCHEMBL7210834 0.75 MMP13 (0.61) MMP2MMP13MMP1
SCHEMBL7210567 0.75 MMP2 (0.55) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7215401 0.75 MMP2 (0.50) MMP2MMP13MMP1MMP3MMP7
SCHEMBL6769491 0.74 MMP13 (0.77) MMP2MMP13MMP1
SCHEMBL6767563 0.74 MMP13 (0.77) MMP2MMP13MMP1
SCHEMBL6767568 0.74 MMP13 (0.77) MMP2MMP13MMP1
SCHEMBL7685949 0.74 MMP13 (0.56) MMP2MMP13MMP1LMNAKMT2A

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-0984959-B1 AROMATIC SULFONYL ALPHA-HYDROXY HYDROXAMIC ACID COMPOUNDS PHARMACIA CORP (US) 2003-09-24 EP disclosed
US-6362183-B1 PROTEASE INHIBITORS; RHEUMATIC DISEASES; ANTITUMOR AGENTS G. D. SEARLE & COMPANY 2002-03-26 US disclosed