SCHEMBL1343485

SCHEMBL1343485

CCOC(=O)[C@@H](N)CCNC(=N)NCCOC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.36
MAPK1 P28482 1/20 0.36
MARS1 P56192 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PTGER4 P35408 1/20 0.33
NOD1 Q9Y239 2/20 0.33
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DDAH1 O94760 1/20 0.31
POLB P06746 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
SCHEMBL1343294 0.90 MARS1 (0.36) HPGDMAPK1MARS1MEN1KMT2A
SCHEMBL1345418 0.89 HPGD (0.35) HPGDMARS1MEN1KMT2ATDP1
SCHEMBL1345236 0.87 NOD1 (0.39) MARS1NOD1ALDH1A1
SCHEMBL1345051 0.84 HPGD (0.32) HPGDMAPK1MARS1MEN1KMT2A
SCHEMBL1345150 0.83 DDAH1 (0.42) HPGDTDP1ALDH1A1DDAH1
SCHEMBL1344938 0.79 SLC1A3 (0.47) HPGDMAPK1CYP2D6CYP2C9CYP2C19
SCHEMBL1343488 0.76 DDAH1 (0.43) HPGDMARS1CYP2D6CYP2C9CYP2C19
SCHEMBL4093663 0.73 ALDH1A1 (0.38) HPGDMEN1KMT2ATDP1ALDH1A1
SCHEMBL1345589 0.72 DPP7 (0.42) HPGDTDP1ALDH1A1DDAH1
SCHEMBL9330200 0.71 DPP7 (0.42) MEN1KMT2ANOD1

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
EP-1828109-B1 GUANIDINE DERIVATIVES AS INHIBITORS OF DDAH UCL BUSINESS PLC (GB) 2013-06-05 EP disclosed
US-8063104-B2 Guanidine derivatives as inhibitors of DDAH UCL BUSINESS PLC (GB) 2011-11-22 US disclosed
US-20090069331-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF DDAH UCL Biomedica PLC c/o Finance Division University College of London (GB) 2009-03-12 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-20090069331-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF DDAH DDAH1, DOHH, IMPDH1 HPGD 148/4885MAPK1 1979/4885MARS1 1572/4885

“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.