SCHEMBL14199839

SCHEMBL14199839

CC(C)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.36
NPY1R P25929 8/20 0.36
NPY5R Q15761 7/20 0.36
NPY2R P49146 4/20 0.36
FOLH1 Q04609 2/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
C3AR1 Q16581 1/20 0.35
ALOX15 P16050 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
NOD1 Q9Y239 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
SCHEMBL9298017 1.00 NPY4R (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL4572687 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL4572697 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL4572685 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL638492 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL4572695 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL4782556 0.89 NPY4R (0.38) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL30493180 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL163852 0.89 FOLH1 (0.36) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL13402566 0.89 NPY4R (0.42) NPY4RNPY1RNPY5RNPY2RALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 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-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 NPY4R 1297/4885NPY1R 599/4885NPY5R 1278/4885

“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.