SCHEMBL6096786

SCHEMBL6096786

COc1ccccc1N1CCC(C2CCN(S(=O)(=O)C3(C(=O)NO)CCN(Cc4ccccc4)CC3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 11/20 0.55
MMP1 P03956 9/20 0.55
MMP9 P14780 9/20 0.55
ADAM17 P78536 9/20 0.55
MMP2 P08253 3/20 0.48
POLB P06746 1/20 0.48
HTR7 P34969 1/20 0.48
ADRA1B P35368 1/20 0.47
ADAMTS4 O75173 1/20 0.47
MMP3 P08254 1/20 0.47
MMP7 P09237 1/20 0.47
MMP8 P22894 1/20 0.47
MMP14 P50281 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL7627818 0.77 MMP1 (0.71) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6095559 0.77 MMP13 (0.56) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6095774 0.73 MMP1 (0.54) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6096396 0.73 ADRB2 (0.54) MMP13MMP1MMP9ADAM17MMP2
Hydrochloric Acid SCHEMBL6097341 0.72 ADRB2 (0.53) MMP13MMP1MMP9ADAM17MMP2
Hydrochloric Acid SCHEMBL6466769 0.72 MMP1 (0.53) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL7504799 0.72 ADAM17 (0.68) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6097553 0.72 TSHR (0.52) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6567122 0.71 MMP1 (1.00) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL9225440 0.70 MAPK1 (0.81) HTR7ADRA1BKDM4E

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 MMP13 23/4885MMP1 4/4885MMP9 7/4885

“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.