SCHEMBL10323924

SCHEMBL10323924

NCCC(NC(=O)c1cc(C(N)=O)c(Cl)cc1F)c1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DCAF1 Q9Y4B6 7/20 0.47
MAPK1 P28482 11/20 0.45
AURKA O14965 1/20 0.45
CTSA P10619 1/20 0.43

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
SCHEMBL10323925 0.88 DCAF1 (0.46) DCAF1MAPK1
SCHEMBL10324846 0.83 DYRK1A (0.51) DCAF1MAPK1AURKA
SCHEMBL10322147 0.83 DYRK1A (0.51) DCAF1MAPK1AURKA
SCHEMBL10322647 0.77 DYRK1A (0.48) DCAF1MAPK1AURKA
SCHEMBL22077638 0.76 DCAF1 (0.43) DCAF1MAPK1AURKACTSA
SCHEMBL10322490 0.74 ROCK2 (0.51) DCAF1MAPK1AURKA
SCHEMBL10324847 0.74 DYRK1A (0.51) MAPK1
SCHEMBL10322148 0.74 DYRK1A (0.51) MAPK1
SCHEMBL10323130 0.74 ROCK2 (0.51) DCAF1MAPK1AURKA
SCHEMBL10324927 0.74 ROCK2 (0.51) DCAF1MAPK1AURKA

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-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 US claimed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 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 (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-20120184542-A1 PYRIDO PYRIMIDINES TYMS, TYMP, DPYD DCAF1 1970/4885MAPK1 1900/4885AURKA 243/4885

“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.