SCHEMBL5822141

SCHEMBL5822141

O=C(c1ccccc1)c1cnn2c(-c3cccc(NC(=O)C4CC4)c3)ccnc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDKN1A P38936 1/20 0.75
MAPK13 O15264 2/20 0.54
PIM1 P11309 2/20 0.54
BRAF P15056 8/20 0.52
GAA P10253 1/20 0.52
GSK3A P49840 2/20 0.52
EPHA2 P29317 1/20 0.52
MAP2K1 Q02750 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
MAPK9 P45984 1/20 0.48
DYRK1A Q13627 1/20 0.48
IRAK4 Q9NWZ3 1/20 0.48
LIMK1 P53667 1/20 0.47
MARK2 Q7KZI7 1/20 0.47
AKT1 P31749 1/20 0.47
PIM3 Q86V86 1/20 0.47
TLR8 Q9NR97 1/20 0.47
JAK2 O60674 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL10736290 0.96 CDKN1A (0.70) CDKN1AMAPK13PIM1BRAFGAA
SCHEMBL5808576 0.89 CDKN1A (0.72) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL10733510 0.88 GSK3A (0.59) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL10759961 0.87 CDKN1A (0.70) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL7361381 0.86 PIM1 (0.60) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL5820151 0.86 CDKN1A (0.74) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL7363602 0.86 MAPK13 (0.57) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL5823272 0.85 CDKN1A (1.00) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL6071300 0.85 CDKN1A (0.78) CDKN1AMAPK13PIM1BRAFGSK3A
SCHEMBL5819944 0.85 PIM1 (0.57) CDKN1AMAPK13PIM1BRAFGSK3A

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
US-20060063784-A1 Method of using substituted pyrazolo [1,5-a] pyrimidines WYETH 2006-03-23 US claimed
WO-2006033795-A2 SUBSTITUTED PYRAZOLO [1, 5-A] PYRIMIDINES FOR INHIBITING ABNORMAL CELL GROWTH WYETH (US) 2006-03-30 WO disclosed
US-20060063784-A1 Method of using substituted pyrazolo [1,5-a] pyrimidines WYETH 2006-03-23 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-20060063784-A1 Method of using substituted pyrazolo [1,5-a] pyrimidines TYMP, DPYD, TYMS CDKN1A 89/4885MAPK13 1727/4885PIM1 797/4885

“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.