SCHEMBL4199957

SCHEMBL4199957

CC(C)(C)OC(=O)NCCC(N)c1cnn2c1N(C=O)CC2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
GAA P10253 1/20 0.37
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
DRD2 P14416 6/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GFER P55789 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL4204213 0.89 MEN1 (0.35) MEN1KMT2AGAASTK17BSTK17A
SCHEMBL4193786 0.78 MEN1 (0.38) MEN1KMT2AGAASTK17BSTK17A
SCHEMBL4207415 0.76 MEN1 (0.37) MEN1KMT2AGAASTK17BSTK17A
SCHEMBL27696909 0.65 MEN1 (0.53) MEN1KMT2AGAAMAOAMAOB
SCHEMBL10317785 0.65 MEN1 (0.50) MEN1KMT2AGAANPSR1ALDH1A1
SCHEMBL10318441 0.65 MEN1 (0.50) MEN1KMT2AGAANPSR1ALDH1A1
SCHEMBL10317783 0.65 MEN1 (0.50) MEN1KMT2AGAANPSR1ALDH1A1
SCHEMBL5019056 0.64 MEN1 (0.59) MEN1KMT2AGAAMAOAMAOB
SCHEMBL12954842 0.63 MEN1 (0.54) MEN1KMT2AGAAMAOAMAOB
SCHEMBL19007632 0.63 MEN1 (0.54) MEN1KMT2AGAAMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012054-A1 Cephem Compounds and Use as Antimicrobial Agents ASTELLAS PHARMA INC. (JP) 2009-01-08 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-20090012054-A1 Cephem Compounds and Use as Antimicrobial Agents CEP170, Q6ZSR9, H1-10 MEN1 590/4885KMT2A 2117/4885GAA 4701/4885

“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.