SCHEMBL942008

SCHEMBL942008

O=C(CCl)OC(=O)CC/C(=N/O)OC(=O)CCl

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL2750422 0.82 ALDH1A1 (0.48) ALDH1A1
SCHEMBL5968591 0.81 EGLN1 (0.39) ALDH1A1
SCHEMBL731664 0.81 ALDH1A1 (0.46) ALDH1A1
SCHEMBL733088 0.79 ALDH1A1 (0.62) ALDH1A1
SCHEMBL1768486 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL781568 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL10972290 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL6738571 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL515928 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL5069484 0.76 LMNA (0.42) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110021765-A1 FLUORINATED LANTHANIDE PROBES FOR 19F MAGNETIC RESONANCE APPLICATIONS UNIVERSITY OF DURHAM (GB) 2011-01-27 US disclosed
EP-2148881-A1 FLUORINATED LANTHANIDE PROBES FOR 19F MAGNETIC RESONANCE APPLICATIONS UNIVERSITY OF DURHAM (GB) 2010-02-03 EP disclosed
WO-2008132433-A1 FLUORINATED LANTHANIDE PROBES FOR 19F MAGNETIC RESONANCE APPLICATIONS UNIVERSITY OF DURHAM (GB) 2008-11-06 WO disclosed
US-20050070480-A1 Peptide arginals and methods for treating disseminated intravascular coagulation IVAX DRUG RESEARCH INSTITUTE LTD. (HU) 2005-03-31 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 (2 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-20110021765-A1 FLUORINATED LANTHANIDE PROBES FOR 19F MAGNETIC RESONANCE APPLICATIONS SLC6A3, SLC39A3, L3MBTL3 ALDH1A1 3488/4885
US-20050070480-A1 Peptide arginals and methods for treating disseminated intravascular coagulation ARGLU1, PLAT, SERPINC1 ALDH1A1 4482/4885

“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.