SCHEMBL7196935

SCHEMBL7196935

NCCCCC(NCCl)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.57
GSR P00390 1/20 0.48
RNPEP Q9H4A4 1/20 0.47
SLC6A5 Q9Y345 1/20 0.44
CPB2 Q96IY4 9/20 0.44
GGT1 P19440 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
SLC15A2 Q16348 1/20 0.39
TLR2 O60603 1/20 0.38

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
SCHEMBL7204362 0.94 FOLH1 (0.50) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL9755508 0.85 FOLH1 (0.50) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL610134 0.82 GGT1 (0.62) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL148480 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL7225798 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL610133 0.82 GGT1 (0.62) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL6316197 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL7198299 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL7076576 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2
SCHEMBL6859366 0.82 FOLH1 (0.54) FOLH1GSRRNPEPSLC6A5CPB2

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 FOLH1 39/4885GSR 1038/4885RNPEP 1764/4885

“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.