SCHEMBL4259154

SCHEMBL4259154

CC(CO)(CO)Nc1ncc2c(n1)NCNC2=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
P2RX3 P56373 1/20 0.33
P2RX2 Q9UBL9 1/20 0.33
LATS1 O95835 1/20 0.30
LATS2 Q9NRM7 1/20 0.30

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
SCHEMBL3278092 0.90 NPSR1 (0.36) PIM1PIM2P2RX3P2RX2LATS1
SCHEMBL3282577 0.79 MAPK1 (0.37) P2RX3P2RX2
SCHEMBL3277903 0.74 MB (0.41) P2RX3P2RX2
SCHEMBL5492570 0.70 HSP90AB1 (0.33) PIM1PIM2
SCHEMBL16005657 0.63 NPSR1 (0.44) P2RX3P2RX2LATS1LATS2
SCHEMBL3278249 0.63 MB (0.43)
SCHEMBL3278309 0.62 MKNK1 (0.49)
SCHEMBL3277912 0.61 P2RX3 (0.31) P2RX3P2RX2
SCHEMBL5422250 0.60 MKNK2 (0.36)
SCHEMBL10722285 0.59 LMNA (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048442-A1 Novel compounds SMITHKLINE BEECHAM CORPORATION 2009-02-19 US disclosed
US-20070167467-A1 1,5-DISUBSTITUTED-3,4-DIHYDRO-1H-PYRIMIDO[4,5-D]PYRIMIDIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CSBP/P38 KINASE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION 2007-07-19 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 (2 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-20070167467-A1 1,5-DISUBSTITUTED-3,4-DIHYDRO-1H-PYRIMIDO[4,5-D]PYRIMIDIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CSBP/P38 KINASE MEDIATED DISEASES MAPKAPK2, CREBBP, CNBP PIM1 1586/4885PIM2 1527/4885P2RX3 1468/4885
US-20090048442-A1 Novel compounds CREBBP, MAPKAPK2, CNBP PIM1 827/4885PIM2 831/4885P2RX3 2250/4885

“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.