SCHEMBL6402216

SCHEMBL6402216

CC(C)C[C@@H](CS(=O)(=O)Cc1cnc2ccccc2c1)N(O)C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.39
MMP9 P14780 2/20 0.39
MMP8 P22894 1/20 0.39
PDE10A Q9Y233 4/20 0.37
MMP13 P45452 3/20 0.37
CYP1A2 P05177 1/20 0.36
HIF1A Q16665 1/20 0.36
EPAS1 Q99814 1/20 0.36
MMP3 P08254 1/20 0.36
ADAM17 P78536 1/20 0.36
MMP17 Q9ULZ9 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
CCR1 P32246 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
ADAMTS4 O75173 1/20 0.35
CYP3A4 P08684 1/20 0.35
MMP14 P50281 1/20 0.35
KCNH2 Q12809 1/20 0.35
RAB9A P51151 1/20 0.34

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
SCHEMBL6402218 1.00 MMP2 (0.39) MMP2MMP9MMP8PDE10AMMP13
SCHEMBL6401571 0.92 MMP2 (0.39) MMP2MMP9MMP8PDE10AMMP13
SCHEMBL6401582 0.89 CYP1A2 (0.38) PDE10ACYP1A2HIF1AEPAS1PTGES
SCHEMBL6400533 0.89 CYP1A2 (0.38) PDE10ACYP1A2HIF1AEPAS1PTGES
SCHEMBL6406029 0.87 KMT2A (0.38) MMP2PDE10AMMP13CYP1A2HIF1A
SCHEMBL6406024 0.87 KMT2A (0.38) MMP2PDE10AMMP13CYP1A2HIF1A
SCHEMBL6403845 0.87 HPGD (0.43) MMP2MMP9MMP8PDE10AMMP13
SCHEMBL6606372 0.87 HPGD (0.43) MMP2MMP9MMP8PDE10AMMP13
SCHEMBL6399844 0.86 MMP2 (0.40) MMP2MMP9PDE10AMMP13CYP1A2
SCHEMBL6399841 0.86 MMP2 (0.40) MMP2MMP9PDE10AMMP13CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288376-A1 Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides SMITHKLINE BEECHAM PLC 2005-12-29 US claimed
EP-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP claimed
US-20040024066-A1 Bicyclyl or heterobicyclylmethanesulfonylamino-substituted n-hydroxyformamides SMITHKLINE BEECHAM P.L.C. (GB) 2004-02-05 US claimed
EP-1289980-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2003-03-12 EP claimed
WO-2001090100-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-29 WO claimed
US-20050288376-A1 Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides SMITHKLINE BEECHAM PLC 2005-12-29 US disclosed
EP-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP disclosed
US-20040024066-A1 Bicyclyl or heterobicyclylmethanesulfonylamino-substituted n-hydroxyformamides SMITHKLINE BEECHAM P.L.C. (GB) 2004-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050288376-A1 Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides CD22, CD2, NEU3 MMP2 2931/4885MMP9 3613/4885MMP8 2573/4885
US-20040024066-A1 Bicyclyl or heterobicyclylmethanesulfonylamino-substituted n-hydroxyformamides CD22, CD2, NEU3 MMP2 2846/4885MMP9 3775/4885MMP8 2510/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.