SCHEMBL7555893

SCHEMBL7555893

CCCCOc1ccc(S(=O)(=O)C2CC(C(=O)O)CCN2Cc2ccc(F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 12/20 0.53
MMP1 P03956 3/20 0.49
MMP9 P14780 2/20 0.49
MMP13 P45452 2/20 0.49
S1PR1 P21453 6/20 0.48
S1PR3 Q99500 4/20 0.48
HRH3 Q9Y5N1 1/20 0.43
ADAM17 P78536 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2D6 P10635 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 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
SCHEMBL27555705 0.92 S1PR5 (0.54) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL7619211 0.92 S1PR5 (0.53) S1PR5MMP1MMP9MMP13S1PR1
Hydroxyamine SCHEMBL7463488 0.90 S1PR5 (0.52) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL7512543 0.89 TAS2R14 (0.50) MMP1MMP9MMP13ADAM17KMT2A
Hydroxyamine SCHEMBL7463594 0.86 HRH3 (0.55) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL7509653 0.83 CCR8 (0.49) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL7952260 0.83 LTA4H (0.52) S1PR5MMP1MMP9MMP13HRH3
Hydroxyamine SCHEMBL7462750 0.81 KCNH2 (0.46) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL6863576 0.81 ADAM17 (0.56) S1PR5MMP1MMP9MMP13S1PR1
SCHEMBL7506020 0.81 S1PR5 (0.53) S1PR5MMP1MMP9MMP13S1PR1

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 S1PR5 991/4885MMP1 7/4885MMP9 16/4885

“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.