SCHEMBL12049697

SCHEMBL12049697

CCOC(=O)c1nc(-c2ccccc2)sc1CO

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 7/20 0.64
DBF4 Q9UBU7 7/20 0.64
TRPM8 Q7Z2W7 4/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
ALDH1A1 P00352 3/20 0.55
HSD17B10 Q99714 2/20 0.55
RARA P10276 1/20 0.55
RARB P10826 1/20 0.55
RARG P13631 1/20 0.55
ALOX5 P09917 1/20 0.54
TARBP2 Q15633 1/20 0.52
HPGD P15428 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.49

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
SCHEMBL2887195 0.88 L3MBTL1 (0.62) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL22939973 0.88 L3MBTL1 (0.62) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL12049696 0.87 L3MBTL1 (0.58) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL12049565 0.87 L3MBTL1 (0.64) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL27931296 0.86 L3MBTL1 (0.60) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL13437316 0.86 L3MBTL1 (0.60) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL2880217 0.85 RARA (0.66) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL20785682 0.83 TRPM8 (0.63) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL2483841 0.83 L3MBTL1 (0.59) CDC7DBF4TRPM8L3MBTL1ALDH1A1
SCHEMBL12049695 0.82 TRPM8 (0.61) CDC7DBF4TRPM8L3MBTL1ALDH1A1

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-20110306609-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC., 2011-12-15 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-20110306609-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRT1, SIRT3, SIRT2 CDC7 1455/4885DBF4 4100/4885TRPM8 1399/4885

“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.