SCHEMBL984203

SCHEMBL984203

COCCN(C)CCOc1cc(C(=O)Nc2ccccc2-c2nc3cccnc3s2)nc(-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.46
THRB P10828 1/20 0.46
POLB P06746 1/20 0.44
TP53 P04637 5/20 0.44
RXFP1 Q9HBX9 1/20 0.43
LMNA P02545 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPK1 P28482 1/20 0.43
AHR P35869 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
GAA P10253 2/20 0.41

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
SCHEMBL13855597 0.95 MAPT (0.44) MAPTTHRBPOLBTP53RXFP1
SCHEMBL12923382 0.88 MAPT (0.43) MAPTTHRBPOLBTP53RXFP1
SCHEMBL12923639 0.88 MAPT (0.46) MAPTTHRBPOLBTP53RXFP1
SCHEMBL12923627 0.87 MAPT (0.47) MAPTTHRBPOLBTP53RXFP1
Hydrochloric Acid SCHEMBL986304 0.87 MAPT (0.43) MAPTTHRBPOLBTP53RXFP1
SCHEMBL13855595 0.87 ALDH1A1 (0.47) MAPTTHRBPOLBTP53RXFP1
SCHEMBL982438 0.87 ALDH1A1 (0.47) MAPTTHRBPOLBTP53RXFP1
SCHEMBL12923376 0.86 MAPT (0.45) MAPTTHRBPOLBTP53RXFP1
Hydrochloric Acid SCHEMBL986333 0.86 MAPT (0.45) MAPTTHRBPOLBTP53RXFP1
SCHEMBL12923628 0.83 MAPT (0.48) MAPTTHRBPOLBTP53RXFP1

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 4 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
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 MAPT 550/4885THRB 525/4885POLB 2703/4885

“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.