SCHEMBL7511090

SCHEMBL7511090

CCCCCCC(Sc1ccccc1OCc1ccccc1)C(=O)NO

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.48
MMP13 P45452 1/20 0.48
ADAM17 P78536 1/20 0.48
PTGES O14684 2/20 0.46
ALOX5 P09917 2/20 0.46
PPARG P37231 1/20 0.43
HDAC8 Q9BY41 4/20 0.42
HDAC3 O15379 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
CTRC Q99895 1/20 0.41
CETP P11597 3/20 0.40
BRD4 O60885 1/20 0.40
MMP1 P03956 3/20 0.39
MMP2 P08253 3/20 0.39
MMP3 P08254 3/20 0.39
MMP7 P09237 3/20 0.39
BIRC2 Q13490 1/20 0.39

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
SCHEMBL6932298 0.83 MMP9 (0.67) MMP9MMP13ADAM17PTGESALOX5
SCHEMBL7509127 0.80 MMP9 (0.44) MMP9MMP13ADAM17PTGESALOX5
SCHEMBL7691773 0.78 MMP9 (0.49) MMP9MMP13ADAM17HDAC8HDAC3
SCHEMBL7623438 0.78 MMP9 (0.42) MMP9MMP13ADAM17PPARGMMP1
SCHEMBL9318904 0.76 PPARG (0.49) PTGESALOX5PPARG
SCHEMBL9318883 0.74 PPARG (0.52) PTGESALOX5PPARG
SCHEMBL7393115 0.72 MMP9 (0.51) MMP9MMP13ADAM17PTGESALOX5
SCHEMBL7317662 0.72 MMP9 (0.55) MMP9MMP13ADAM17PTGESALOX5
SCHEMBL6933064 0.71 MMP9 (0.64) MMP9MMP13ADAM17PTGESALOX5
SCHEMBL7952257 0.71 MMP9 (0.43) MMP9MMP13ADAM17PTGESALOX5

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-20020006922-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) 2002-01-17 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-20020006922-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 15/4885ADAM17 5/4885

“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.