SCHEMBL14469765

SCHEMBL14469765

COc1c(C)ncc(CO)c1CN

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.63
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 1/20 0.50
DPP4 P27487 1/20 0.43
GFER P55789 1/20 0.41
KMT2A Q03164 2/20 0.38
PDXK O00764 2/20 0.38
MEN1 O00255 1/20 0.38
AOX1 Q06278 1/20 0.38
TRIM24 O15164 1/20 0.37
TRIM33 Q9UPN9 1/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.37
GAA P10253 2/20 0.36
HSP90AB1 P08238 2/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL30649291 0.88 KDM4E (0.59) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4056862 0.87 KDM4E (0.50) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL3392208 0.79 KDM4E (0.47) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9970098 0.79 LMNA (0.71) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL14899354 0.78 LMNA (0.59) LMNAKDM4EALDH1A1HPGDHSD17B10
Pyridoxamine SCHEMBL30408 0.77 LMNA (1.00) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11449654 0.77 KDM4E (0.46) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL14899377 0.76 LMNA (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
Pyridoxamine SCHEMBL48103 0.76 LMNA (0.96) LMNAKDM4EALDH1A1HPGDHSD17B10
Pyridoxamine SCHEMBL7749395 0.76 LMNA (0.96) LMNAKDM4EALDH1A1HPGDHSD17B10

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-8431712-B2 Methods for the synthesis of pyridoxamine NEPHROGENEX, INC. (US) 2013-04-30 US disclosed
US-20070161678-A1 Methods for the synthesis of pyridoxamine BIOSTRATUM, INC. 2007-07-12 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-20070161678-A1 Methods for the synthesis of pyridoxamine AGER, PDXK, PNPO LMNA 855/4885KDM4E 229/4885ALDH1A1 335/4885

“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.