SCHEMBL7202563

SCHEMBL7202563

C#C[C@](N)(CCC(C)(C)N)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.35
GRM4 Q14833 1/20 0.34
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
NAALAD2 Q9Y3Q0 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
SCHEMBL7198423 0.82 KDM4E (0.39) GGT1ARG1ARG2
SCHEMBL7204475 0.79 GRM4 (0.31) GRM4
SCHEMBL11404798 0.77 CYP1A2 (0.45) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL11481457 0.76 RNPEP (0.31)
SCHEMBL7198413 0.76 MEN1 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL16587608 0.76
SCHEMBL4813122 0.75 ODC1 (0.47) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL4813109 0.75 ODC1 (0.47) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL4813114 0.75 ODC1 (0.47) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL7204001 0.75 GABRP (0.41) ARG1ARG2

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-6602910-B2 Treating cancer in a patient comprising administering an effective amount of substantially purified D enantiomer of difluoromethylornithine ILEX ONCOLOGY, INC. 2003-08-05 US disclosed
US-20020045663-A1 D-enantiomer of DFMO and methods of use therefor ILEX ONCOLOGY, INC. (US) 2002-04-18 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-20020045663-A1 D-enantiomer of DFMO and methods of use therefor DHODH, DDT, HADHB GGT1 547/4885GRM4 3887/4885ARG1 605/4885

“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.