SCHEMBL2483879

SCHEMBL2483879

CCc1sc(C(=O)O)nc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
MAPT P10636 2/20 0.59
HSD17B10 Q99714 2/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
PTGDR2 Q9Y5Y4 3/20 0.51
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
AR P10275 1/20 0.48
CYP1A2 P05177 1/20 0.48
RORC P51449 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GLA P06280 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL3311788 0.88 ALDH1A1 (0.60) ALDH1A1MAPTHSD17B10HPGDTSHR
SCHEMBL15728786 0.85 ALDH1A1 (0.60) ALDH1A1MAPTHSD17B10HPGDTSHR
SCHEMBL15728785 0.85 ALDH1A1 (0.54) ALDH1A1MAPTHSD17B10HPGDTSHR
SCHEMBL1250021 0.84 GPR84 (0.47) ALDH1A1MAPTHPGDPTGDR2KDM4E
SCHEMBL9830851 0.78 RARA (0.60) ALDH1A1MAPTHSD17B10HPGDKDM4E
SCHEMBL13002963 0.76 ALDH1A1 (0.67) ALDH1A1MAPTHSD17B10HPGDTSHR
SCHEMBL3767221 0.76 ALDH1A1 (0.67) ALDH1A1MAPTHSD17B10HPGDTSHR
SCHEMBL5924855 0.76 ALDH1A1 (0.55) ALDH1A1MAPTKDM4ECYP1A2NPSR1
SCHEMBL11466220 0.76 ALDH1A1 (0.67) ALDH1A1MAPTHSD17B10HPGDPTGDR2
SCHEMBL14960379 0.76 ALDH1A1 (0.74) ALDH1A1MAPTHSD17B10HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492401-B2 Thiazolopyridine sirtuin modulating compounds GLAXOSMITHKLINE LLC (US) 2013-07-23 US disclosed
US-20130085155-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS (US) 2013-04-04 US disclosed
US-8343997-B2 Thiazolopyridine sirtuin modulating compounds SIRTRIS PHARMACEUTICALS, INC. (US) 2013-01-01 US disclosed
US-20110306609-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC., 2011-12-15 US disclosed
EP-2376502-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS Sirtris Pharmaceuticals, Inc. (US) 2011-10-19 EP disclosed
WO-2010071853-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC. (US) 2010-06-24 WO 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 (2 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-20130085155-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRT1, SIRT3, SIRT2 ALDH1A1 722/4885MAPT 735/4885HSD17B10 1106/4885
US-20110306609-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRT1, SIRT3, SIRT2 ALDH1A1 722/4885MAPT 735/4885HSD17B10 1106/4885

“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.