SCHEMBL17522209

SCHEMBL17522209

CN(C)C/C=C/C(=O)OCC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
HCAR2 Q8TDS4 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL8085681 0.80 HCAR2 (0.44) MAPTHCAR2ATM
SCHEMBL5611325 0.80 HCAR2 (0.44) MAPTHCAR2ATM
SCHEMBL5611334 0.80 HCAR2 (0.44) MAPTHCAR2ATM
SCHEMBL663907 0.79 HCAR2 (0.52) MAPTHCAR2ATM
SCHEMBL663908 0.79 HCAR2 (0.52) MAPTHCAR2ATM
SCHEMBL372677 0.77 TDP1 (0.41) MAPTHCAR2ATM
Hydrochloric Acid SCHEMBL665362 0.77 MAPT (0.50) MAPTHCAR2ATM
SCHEMBL13883741 0.77 HDAC6 (0.33)
SCHEMBL16860054 0.77 HDAC6 (0.33)
Hydrochloric Acid SCHEMBL665363 0.77 MAPT (0.50) MAPTHCAR2ATM

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-20160046634-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2016-02-18 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-20160046634-A1 HETEROARYL COMPOUNDS AND USES THEREOF PRKACA, PRKDC, AURKC MAPT 4190/4885HCAR2 4178/4885ATM 511/4885

“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.