SCHEMBL2867582

SCHEMBL2867582

Nc1ccc2c(c1)[nH]c(=O)c1c(N)n(-c3ccccc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.52
ABL1 P00519 1/20 0.51
LCK P06239 1/20 0.51
FYN P06241 1/20 0.51
LYN P07948 1/20 0.51
SRC P12931 1/20 0.51
MAPK14 Q16539 1/20 0.51
PARP1 P09874 3/20 0.44
CHEK1 O14757 1/20 0.42
AURKA O14965 1/20 0.42
CSNK1A1 P48729 1/20 0.42
CDK8 P49336 1/20 0.42
NEK2 P51955 1/20 0.42
LIMK1 P53667 1/20 0.42
CDK5 Q00535 1/20 0.42
DYRK1A Q13627 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
ADORA3 P0DMS8 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40

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
SCHEMBL2868597 0.88 TDP2 (0.56) TDP2ABL1LCKFYNLYN
SCHEMBL2861092 0.87 ADORA3 (0.53) TDP2ABL1LCKFYNLYN
SCHEMBL2861630 0.85 ADORA3 (0.46) TDP2PARP1ADORA3MEN1RAB9A
SCHEMBL2859052 0.84 TDP2 (0.45) TDP2ABL1LCKFYNLYN
SCHEMBL2856015 0.84 PTGS2 (0.57) TDP2ABL1LCKFYNLYN
SCHEMBL2868711 0.79 TDP2 (0.47) TDP2ABL1LCKFYNLYN
SCHEMBL13067107 0.79 TDP2 (0.44) TDP2ABL1LCKFYNLYN
SCHEMBL2864315 0.78 ADORA3 (0.50) TDP2ABL1LCKFYNLYN
SCHEMBL2868721 0.78 ADORA3 (0.45) TDP2ABL1LCKFYNLYN
SCHEMBL2872710 0.78 ADORA3 (0.57) TDP2ABL1LCKFYNLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-7842701-B2 Pyrazoloquinolone derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-30 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
US-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof TAKEDA PHARMACEUTICAL COMPANY (JP) 2007-12-06 US disclosed
EP-1719771-A1 PYRAZOLOQUINOLONE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-11-08 EP 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-20070281963-A1 Pyrazoloquinolone Derivative And Use Thereof MAP3K20, MAP4K5, MAP4K3 TDP2 3548/4885ABL1 22/4885LCK 108/4885

“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.