SCHEMBL5528134

SCHEMBL5528134

C=CN(CCN)CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
EYA2 O00167 1/20 0.37
APP P05067 1/20 0.37
ACE P12821 1/20 0.37
BLM P54132 3/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
PMP22 Q01453 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
ALOX15 P16050 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
CYP2C19 P33261 1/20 0.36
ADRA1A P35348 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL3806335 0.81 TDP1 (0.41) TDP1EYA2APPACEBLM
SCHEMBL8768371 0.77
SCHEMBL10999259 0.75 TDP1 (0.34) TDP1EYA2APPACEBLM
SCHEMBL7851190 0.75 TDP1 (0.34) TDP1EYA2APPACEBLM
SCHEMBL7647191 0.74 AKR1B1 (0.40) TDP1APPTSHRALOX15OR51E2
Acetic Acid SCHEMBL28282087 0.74
SCHEMBL28032511 0.73
Water SCHEMBL28243667 0.71 TDP1 (0.33) TDP1EYA2APPACEBLM
SCHEMBL19206931 0.71 TDP1 (0.31) TDP1EYA2APPACEBLM
SCHEMBL1049790 0.71 TDP1 (0.44) TDP1EYA2APPACEBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112655758-B Application of radix glycyrrhizae extract in preparation of fruit and vegetable preservative 广西壮族自治区药用植物园 2024-02-27 CN disclosed
US-9055741-B2 Contacting crop plants with compositions ROHM AND HAAS COMPANY (US) 2015-06-16 US disclosed
EP-1856976-B1 Contacting crop plants with compositions ROHM & HAAS (US) 2014-09-03 EP disclosed
EP-1856976-A2 Contacting crop plants with compositions Rohm and Haas Company (US) 2007-11-21 EP disclosed
US-20070265166-A1 Contacting crop plants with compositions ALTER DOMUS US LLC 2007-11-15 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-20070265166-A1 Contacting crop plants with compositions PIN1, MYB, CROCC TDP1 3322/4885EYA2 961/4885APP 2376/4885

“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.