SCHEMBL4475883

SCHEMBL4475883

N=C(N)Nc1cc[nH]c(=O)n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.33
DYRK1A Q13627 1/20 0.33
KLK1 P06870 1/20 0.32
KLK5 Q9Y337 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
TMPRSS6 Q8IU80 1/20 0.32
ST14 Q9Y5Y6 1/20 0.32

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
SCHEMBL513900 0.83 CYP3A4 (0.38) DYRK1A
Urea SCHEMBL5444104 0.81 CYP3A4 (0.37) DYRK1A
SCHEMBL18114338 0.80 CYP3A4 (0.33)
SCHEMBL1696064 0.80 CYP3A4 (0.33)
SCHEMBL10679044 0.77 GRM5 (0.36)
SCHEMBL21187 0.76 KDM4E (0.47)
Acrylamide SCHEMBL29208545 0.75 BTK (0.36)
SCHEMBL1827089 0.74 KDM4E (0.46)
Methane SCHEMBL27916786 0.74 KDM4E (0.46)
N4-Hydroxycytosine SCHEMBL48396 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504502-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION (US) 2009-03-17 US disclosed
US-7504502-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION (US) 2009-03-17 US disclosed
US-20080171877-A1 GUANIDINOPYRIMIDINONE COMPOUNDS AND PHASE CHANGE INKS CONTAINING SAME XEROX CORPORATION (US) 2008-07-17 US disclosed
US-7371858-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION (US) 2008-05-13 US disclosed
US-7371858-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION (US) 2008-05-13 US disclosed
US-20060149063-A1 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2006-07-06 US disclosed
US-20060149063-A1 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2006-07-06 US disclosed
US-6811595-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2004-11-02 US disclosed
US-6811595-B2 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2004-11-02 US disclosed
US-20040060474-A1 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2004-04-01 US disclosed
US-20040060474-A1 Guanidinopyrimidinone compounds and phase change inks containing same XEROX CORPORATION 2004-04-01 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 (3 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-20060149063-A1 Guanidinopyrimidinone compounds and phase change inks containing same RPP30, INO80, CDK20 F2 3681/4885DYRK1A 2885/4885KLK1 3143/4885
US-20040060474-A1 Guanidinopyrimidinone compounds and phase change inks containing same CCNI, INO80, CCNY F2 1987/4885DYRK1A 3513/4885KLK1 3428/4885
US-20080171877-A1 GUANIDINOPYRIMIDINONE COMPOUNDS AND PHASE CHANGE INKS CONTAINING SAME INO80, RPP30, RO60 F2 3715/4885DYRK1A 2584/4885KLK1 2894/4885

“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.