SCHEMBL1343416

SCHEMBL1343416

CCCCCCCCNC(=N)NCC[C@H](N)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.53
RRM1 P23921 1/20 0.53
NOD1 Q9Y239 5/20 0.51
GNAI3 P08754 1/20 0.50
GNAO1 P09471 1/20 0.50
GNAI1 P63096 1/20 0.50
GRIK1 P39086 2/20 0.47
GRIK2 Q13002 2/20 0.47
EPHX1 P07099 6/20 0.46
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
S1PR2 O95136 2/20 0.43
S1PR1 P21453 2/20 0.43
S1PR3 Q99500 2/20 0.43
S1PR5 Q9H228 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43

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
SCHEMBL21111056 0.92 DPP7 (0.58) DPP7RRM1NOD1GNAI3GNAO1
SCHEMBL29551297 0.89 DPP7 (0.54) DPP7RRM1NOD1GNAI3GNAO1
SCHEMBL8730134 0.87 NOD1 (0.52) DPP7RRM1NOD1GNAI3GNAO1
SCHEMBL1344672 0.87 SLC1A2 (0.42) DPP7NOD1GRIK1GRIK2SLC1A2
SCHEMBL3508097 0.84 OTC (0.50) DPP7RRM1NOD1GNAI3GNAO1
SCHEMBL1004634 0.84 OTC (0.50) DPP7RRM1NOD1GNAI3GNAO1
SCHEMBL30302208 0.83 DPP7 (0.46) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL30286002 0.83 DPP7 (0.46) DPP7NOD1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL30271216 0.83 OTC (0.49) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL2863618 0.81 EPHX1 (0.63) DPP7RRM1NOD1GNAI3GNAO1

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 DPP7 560/4885RRM1 1281/4885NOD1 2690/4885

“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.