SCHEMBL7529617

SCHEMBL7529617

CCN1CCC(C(=O)NO)(S(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CC1.CCOC(=O)C1(S(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CCN(CC)CC1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 14/20 0.89
MMP13 P45452 14/20 0.89
MMP1 P03956 12/20 0.89
ADAM17 P78536 10/20 0.89
HTT P42858 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
CYP1A2 P05177 1/20 0.70
CYP3A4 P08684 1/20 0.70
CYP2D6 P10635 1/20 0.70
CYP2C9 P11712 1/20 0.70
CYP2C19 P33261 1/20 0.70
NPSR1 Q6W5P4 1/20 0.70
MMP2 P08253 5/20 0.68
MMP3 P08254 4/20 0.68
MMP8 P22894 4/20 0.68
MMP14 P50281 4/20 0.68
MMP7 P09237 2/20 0.68
ADAMTS4 O75173 1/20 0.68
ADAMTS5 Q9UNA0 1/20 0.68
MEN1 O00255 2/20 0.66

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
SCHEMBL7406651 0.94 MMP13 (1.00) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7405314 0.93 SMN1; SMN2 (0.76) MMP9MMP13MMP1ADAM17HTT
SCHEMBL7510395 0.85 MMP9 (0.88) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7411815 0.85 MMP9 (0.69) MMP9MMP13MMP1ADAM17HTT
SCHEMBL7411525 0.84 MMP9 (0.75) MMP9MMP13MMP1ADAM17HTT
SCHEMBL7407709 0.84 MMP13 (1.00) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL5919409 0.84 MMP13 (0.81) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7410572 0.83 ALDH1A1 (0.90) MMP9MMP13MMP1ADAM17HTT
SCHEMBL5919267 0.83 MMP13 (0.79) MMP9MMP13MMP1ADAM17MMP2
SCHEMBL7406031 0.82 MMP13 (1.00) MMP9MMP13MMP1ADAM17MMP2

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-20020188120-A1 N-hydroxy-2-(alkyl, aryl, or heteroaryl sulfanyl, sulfinyl, or sulfonyl)-3-substituted alkyl, aryl or heteroarylamides as matrix metalloproteinase inhibitors AMERICAN CYANAMID COMPANY (US) 2002-12-12 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 (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-20020188120-A1 N-hydroxy-2-(alkyl, aryl, or heteroaryl sulfanyl, sulfinyl, or sulfonyl)-3-substituted alkyl, aryl or heteroarylamides as matrix metalloproteinase inhibitors MMP12, ADAM33, MMP2 MMP9 16/4885MMP13 17/4885MMP1 8/4885

“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.