SCHEMBL7572878

SCHEMBL7572878

CCOC(=O)C1CC(S(=O)(=O)c2ccc(OC)cc2)CCN1CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
FKBP1A P62942 4/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
KCNH2 Q12809 1/20 0.46
OPRM1 P35372 1/20 0.44
PKM P14618 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MMP1 P03956 3/20 0.44
MMP9 P14780 3/20 0.44
MMP13 P45452 1/20 0.44
ADAM17 P78536 1/20 0.44
CHRM5 P08912 1/20 0.44
TSHR P16473 1/20 0.42
MMP3 P08254 2/20 0.42
MMP7 P09237 2/20 0.42
MMP2 P08253 1/20 0.42
MMP8 P22894 1/20 0.42

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
SCHEMBL7505846 0.95 ALDH1A1 (0.49) ALDH1A1FKBP1AKMT2APKMMMP1
SCHEMBL7515028 0.87 ALDH1A1 (0.53) ALDH1A1KMT2AKCNH2PKMNPSR1
SCHEMBL7554745 0.86 ALDH1A1 (0.47) ALDH1A1FKBP1AMEN1KMT2APKM
SCHEMBL7549978 0.85 ALDH1A1 (0.56) ALDH1A1MEN1KMT2APKMMMP1
SCHEMBL7555596 0.85 MMP13 (0.47) ALDH1A1FKBP1AMEN1KMT2AHTR2A
SCHEMBL7510199 0.85 KCNH2 (0.51) FKBP1AMEN1KMT2AHTR2AHTR2C
SCHEMBL7552475 0.84 ALDH1A1 (0.53) ALDH1A1KMT2AKCNH2PKMNPSR1
SCHEMBL7510863 0.82 POLB (0.54) MEN1KMT2APKMNPSR1MMP1
SCHEMBL7510118 0.82 KCNH2 (0.50) ALDH1A1MEN1KMT2AHTR2AHTR2C
SCHEMBL7559733 0.82 ALDH1A1 (0.46) ALDH1A1FKBP1AMMP1MMP9MMP13

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 ALDH1A1 3024/4885FKBP1A 2409/4885MEN1 4194/4885

“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.