SCHEMBL13466254

SCHEMBL13466254

CC(C)(C)OC(=O)Nc1cccc(Cc2nn(-c3ccc(F)c(F)c3)ccc2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.38
SYK P43405 1/20 0.38
AURKA O14965 1/20 0.38
RPS6KB1 P23443 1/20 0.38
PARP1 P09874 2/20 0.37
NPY1R P25929 1/20 0.36
MET P08581 1/20 0.36
RORC P51449 3/20 0.36
MAPK14 Q16539 1/20 0.36
AR P10275 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
RIPK3 Q9Y572 1/20 0.35
TLR7 Q9NYK1 1/20 0.35

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
SCHEMBL13465830 0.92 SIRT2 (0.39) SIRT2SYKAURKARPS6KB1PARP1
SCHEMBL12517590 0.89 MET (0.43) SIRT2SYKAURKARPS6KB1PARP1
SCHEMBL13465890 0.88 PARP1 (0.50) PARP1MET
SCHEMBL13465608 0.88 MET (0.39) SIRT2SYKAURKARPS6KB1PARP1
SCHEMBL13274998 0.86 PARP1 (0.40) PARP1MET
SCHEMBL13274785 0.86 LMNA (0.41) PARP1MET
SCHEMBL13274992 0.86 LMNA (0.39) PARP1AR
SCHEMBL13465609 0.85 EGLN2 (0.41) SIRT2AURKARPS6KB1PARP1NPY1R
SCHEMBL255591 0.84 RORC (0.40) SIRT2AURKARPS6KB1PARP1RORC
SCHEMBL13465900 0.84 MET (0.41) PARP1METCYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 SIRT2 4146/4885SYK 116/4885AURKA 494/4885

“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.