SCHEMBL983130

SCHEMBL983130

CC(C)CNc1cc(C(=O)Nc2ccccc2-c2nc3cccnc3s2)nc(-c2ccccc2)n1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
MAPT P10636 6/20 0.49
TP53 P04637 5/20 0.49
KDM4E B2RXH2 3/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 7/20 0.46
THRB P10828 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HTT P42858 2/20 0.45
ALOX15 P16050 1/20 0.45
HPGD P15428 2/20 0.44
AHR P35869 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL12923586 0.90 MAPT (0.45) GAAMAPTTP53KDM4EMAPK1
SCHEMBL12923585 0.90 MAPT (0.45) GAAMAPTTP53KDM4EMAPK1
SCHEMBL12923506 0.90 MAPT (0.47) GAAMAPTTP53KDM4EMAPK1
Hydrochloric Acid SCHEMBL983729 0.89 MAPT (0.46) GAAMAPTTP53KDM4EMAPK1
SCHEMBL12923608 0.88 MAPT (0.49) GAAMAPTTP53KDM4EMAPK1
SCHEMBL985252 0.88 MAPT (0.48) GAAMAPTTP53KDM4EMAPK1
SCHEMBL981424 0.88 MAPT (0.48) GAAMAPTTP53KDM4EMAPK1
SCHEMBL985548 0.88 MAPT (0.53) GAAMAPTTP53KDM4EMAPK1
SCHEMBL985647 0.88 MAPT (0.48) GAAMAPTTP53KDM4EMAPK1
SCHEMBL985220 0.88 MAPT (0.48) GAAMAPTTP53KDM4EMAPK1

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-20110009381-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTIS PHARMACEUTICALS, INC. (US) 2011-01-13 US disclosed
US-20110009381-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTIS PHARMACEUTICALS, INC. (US) 2011-01-13 US disclosed
US-20110009381-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTIS PHARMACEUTICALS, INC. (US) 2011-01-13 US disclosed
EP-2217606-A1 SOLUBILIZED THIAZOLOPYRIDINES Sirtris Pharmaceuticals, Inc. (US) 2010-08-18 EP disclosed
WO-2009061453-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTRIS PHARMACEUTICALS, INC. (US) 2009-05-14 WO disclosed
WO-2009061453-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTRIS PHARMACEUTICALS, INC. (US) 2009-05-14 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 (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-20110009381-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRT3, SIRT1, SIRT2 GAA 443/4885MAPT 550/4885TP53 515/4885

“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.