SCHEMBL6098660

SCHEMBL6098660

O=C(NOC1CCCCO1)C1(S(=O)(=O)N2CCC(Oc3ccc(C(F)(F)F)cc3)CC2)CCN(Cc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.48
SLC6A5 Q9Y345 1/20 0.43
MMP13 P45452 5/20 0.42
MMP2 P08253 4/20 0.42
SIGMAR1 Q99720 3/20 0.41
FAAH O00519 1/20 0.40
PRKAA2 P54646 1/20 0.40
OPRL1 P41146 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
ADAM17 P78536 1/20 0.38
EPHX2 P34913 1/20 0.38
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6094620 0.87 MMP13 (0.43) ADRB2MMP13MMP2MMP1MMP9
SCHEMBL6095579 0.87 MMP13 (0.41) ADRB2MMP13MMP2MMP1MMP9
SCHEMBL6096034 0.86 MMP13 (0.42) ADRB2MMP13MMP2MMP1MMP9
SCHEMBL6096396 0.85 ADRB2 (0.54) ADRB2SLC6A5MMP13MMP2SIGMAR1
SCHEMBL6097003 0.85 MMP13 (0.41) ADRB2MMP13MMP2PRKAA2MMP9
SCHEMBL6097845 0.85 ADRB2 (0.40) ADRB2MMP13MMP2MMP9
Hydrochloric Acid SCHEMBL6097341 0.85 ADRB2 (0.53) ADRB2SLC6A5MMP13MMP2SIGMAR1
SCHEMBL6096620 0.84 ADRB2 (0.52) ADRB2SLC6A5MMP13MMP2SIGMAR1
SCHEMBL6098789 0.83 MMP2 (0.52) MMP13MMP2POLBGAAMMP1
SCHEMBL6095591 0.83 GPR119 (0.39) ADRB2MMP13MMP2PRKAA2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067670-B2 Sulfamato hydroxamic acid metalloprotease inhibitor WARNER LAMBERT COMPANY (US) 2006-06-27 US disclosed
US-20050049280-A1 Sulfamato hydroxamic acid metalloprotease inhibitor PHARMACIA CORPORATION 2005-03-03 US disclosed
US-6800646-B1 Sulfamato hydroxamic acid metalloprotease inhibitor PHARMACIA CORPORATION 2004-10-05 US disclosed
US-6492367-B1 Sulfamato hydroxamic acid metalloprotease inhibitor G. D. SEARLE & COMPANY 2002-12-10 US disclosed
US-6448250-B1 INHIBITS THE ACTIVITY OF ONE OR MORE OF THE FOLLOWING MATRIX METALLOPROTEINASES: MMP-2, MMP-9, AND MMP-13, WHILE EXHIBITING SUBSTANTIALLY LESS INHIBITORY ACTIVITY AGAINST MMP-1 G. D. SEARLE & COMPANY 2002-09-10 US disclosed
EP-1157021-A1 SULFAMATO HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2001-11-28 EP disclosed
WO-2000046221-A1 SULFAMATO HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2000-08-10 WO 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 (1 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-20050049280-A1 Sulfamato hydroxamic acid metalloprotease inhibitor MMP14, MMP12, MMP17 ADRB2 4884/4885SLC6A5 1841/4885MMP13 23/4885

“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.