SCHEMBL3519224

SCHEMBL3519224

N#Cc1cnc(-c2cccnc2)[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 10/20 0.57
MAPT P10636 2/20 0.49
HPGD P15428 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
BTK Q06187 1/20 0.49
HPGDS O60760 2/20 0.48
CYP11B2 P19099 1/20 0.44

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
SCHEMBL3521755 0.84 RECQL (0.54) NPY5RHPGD
SCHEMBL11018440 0.79 HPGD (0.56) NPY5RHPGDHPGDS
SCHEMBL4471712 0.78 ALDH1A1 (0.53) NPY5RHPGDBTKCYP11B2
SCHEMBL6889908 0.77 NPY5R (0.55) NPY5RMAPTHPGDKDM4CBTK
SCHEMBL11624684 0.74 SCN2A (0.59) NPY5R
SCHEMBL11627315 0.74 KDM4E (0.63) NPY5RHPGD
SCHEMBL3523901 0.73 NPY5R (0.55) NPY5RMAPTHPGDKDM4CBTK
SCHEMBL1442878 0.73 RECQL (0.73) NPY5RMAPTHPGDKDM4CBTK
SCHEMBL10911458 0.73 PDE3A (0.71) HPGD
SCHEMBL10807931 0.73 FASN (0.50) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795271-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2010-09-14 US disclosed
US-20090306108-A1 SUBSTITUTED PYRIMIDINONES PFIZER INC 2009-12-10 US disclosed
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES PHARMACIA CORPORATION (US) 2007-07-19 US disclosed
CN-1968937-A Pyrimidin-4-one derivatives and their use as P38 kinase modulators PHARMACIA CORP (US) 2007-05-23 CN disclosed
US-7183287-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2007-02-27 US disclosed
US-20040242608-A1 Substituted pyrimidinones PHARMACIA LLC 2004-12-02 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-20090306108-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 NPY5R 1762/4885MAPT 2576/4885HPGD 418/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 NPY5R 1979/4885MAPT 3038/4885HPGD 442/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 NPY5R 1762/4885MAPT 2576/4885HPGD 418/4885

“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.