SCHEMBL5558701

SCHEMBL5558701

CCOC(=O)CC(CC(C)C)C(=O)NCCc1ccc(-c2cccc(OC)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
CTSK P43235 3/20 0.46
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
MMP8 P22894 2/20 0.45
GLA P06280 1/20 0.44
KMT2A Q03164 1/20 0.44
MAOB P27338 2/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
SLC13A5 Q86YT5 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
ATM Q13315 1/20 0.42
PTPN1 P18031 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
SCHEMBL5552466 0.90 ATM (0.49) CTSKMMP2MMP9MMP8KMT2A
SCHEMBL5556645 0.90 KMT2A (0.55) MAPTMMP2MMP9MMP8GLA
SCHEMBL5552337 0.89 MMP8 (0.47) MAPTCTSKMMP2MMP9MMP8
SCHEMBL5556818 0.88 MMP8 (0.56) MMP2MMP9MMP8
SCHEMBL5552342 0.87 MMP2 (0.60) MAPTCTSKMMP2MMP9MMP8
SCHEMBL5558599 0.78 MMP9 (0.57) MMP2MMP9MMP8
SCHEMBL5552855 0.77 ERAP2 (0.59) MMP2MMP9MMP8ATM
SCHEMBL5552823 0.77 MMP9 (0.62) MMP2MMP9MMP8ATM
SCHEMBL5556793 0.76 MMP2 (0.61) MAPTMMP2MMP9MMP8
SCHEMBL5556462 0.75 MMP2 (0.63) MMP2MMP9MMP8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197577-A1 Inhibitors of anthrax lethal factor CENGENT THERAPEUTICS (US) 2007-08-23 US disclosed
WO-2005027856-A2 INHIBITORS OF ANTHRAX LETHAL FACTOR CENGENT THERAPEUTICS (US) 2005-03-31 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-20070197577-A1 Inhibitors of anthrax lethal factor APAF1, ANTXR2, LITAF MAPT 4430/4885CTSK 306/4885MMP2 85/4885

“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.