SCHEMBL4283577

SCHEMBL4283577

CCOC(OCCOC)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
DDAH1 O94760 1/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL30602603 0.88 CA2 (0.36) DDAH1MEN1KMT2A
SCHEMBL559406 0.84 ALOX15 (0.46) ALOX15MEN1CYP1A2KMT2AALDH1A1
SCHEMBL1664818 0.81 ALDH1A1 (0.34) DDAH1ALDH1A1
SCHEMBL29110828 0.79 GAA (0.34) ALOX15KMT2AALDH1A1GAARAB9A
SCHEMBL6934423 0.76 ALDH1A1 (0.32) DDAH1ALDH1A1
SCHEMBL7367907 0.75 DDAH1 (0.33) ALOX15DDAH1
SCHEMBL10702225 0.74 DDAH1 (0.38) DDAH1ALDH1A1
Isobutyramide SCHEMBL28185255 0.72 ALDH1A1 (0.36) ALOX15DDAH1ALDH1A1
SCHEMBL27789246 0.71
SCHEMBL4283583 0.71 LMNA (0.39) ALOX15

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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA PGLS, TFPI, Q6ZSR9 ALOX15 3970/4885DDAH1 2179/4885MEN1 4659/4885

“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.