SCHEMBL5568004

SCHEMBL5568004

CN(CCCCN(S)C(N)=O)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.36
CTSK P43235 2/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
AAK1 Q2M2I8 1/20 0.32
PDK2 Q15119 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CACNA1G O43497 1/20 0.30
CACNA1B Q00975 1/20 0.30
CACNA1C Q13936 1/20 0.30
GBA1 P04062 1/20 0.30
LMNA P02545 1/20 0.30
METAP2 P50579 1/20 0.30

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
SCHEMBL21235768 0.81 HDAC6 (0.42) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL25736655 0.81 HDAC6 (0.38) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL1654128 0.80 CA14 (0.40) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL9219474 0.80 HDAC6 (0.40) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL28909787 0.78 CHRM2 (0.42) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL2722798 0.78 CHRM2 (0.42) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL22291496 0.78 CHRM2 (0.42) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL18391125 0.78 CHRM2 (0.42) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL55404 0.78 HDAC6 (0.38) CA14CTSKHDAC1HDAC2HDAC6
SCHEMBL2478206 0.78 TDP1 (0.44) CA14CTSKHDAC1HDAC2HDAC6

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
EP-1480976-B1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-09-19 EP disclosed
US-6686381-B2 COMPOUNDS THAT ANTAGONIZE NEUROPEPTIDE Y AT THE Y5 RECEPTOR SUBTYPE REPRESENT AN APPROACH TO THE TREATMENT OF EATING DISORDERS SUCH AS OBESITY AND HYPERPHAGIA HOFFMANN-LA ROCHE INC. 2004-02-03 US disclosed
US-20030225141-A1 THIAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. 2003-12-04 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-20030225141-A1 THIAZOLE DERIVATIVES SLC5A1, GPR119, TAS1R1 CA14 3366/4885CTSK 3218/4885HDAC1 203/4885

“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.