SCHEMBL5569873

SCHEMBL5569873

Cc1cccnc1C(=O)c1cnc(NCCC(N)=O)s1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 2/20 0.44
MAPK14 Q16539 5/20 0.43
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 1/20 0.39
LCK P06239 3/20 0.39
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
PIK3CG P48736 1/20 0.38

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
SCHEMBL5569877 0.86 MAPK14 (0.43) TMPRSS15MAPK14NPC1CYP1A2CYP3A4
SCHEMBL5568753 0.84 P2RX7 (0.45) TMPRSS15MAPK14MAPK13MAPK12MAPK11
SCHEMBL5567861 0.84 MAPK14 (0.46) MAPK14NPC1CYP1A2CYP3A4CYP2C9
SCHEMBL5564286 0.80 SIRT3 (0.45) TMPRSS15MAPK14LCKMAPK13MAPK12
SCHEMBL5564231 0.78 MAPK13 (0.63) TMPRSS15MAPK14NPC1CYP1A2CYP3A4
SCHEMBL5569154 0.78 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5564650 0.78 TMPRSS15 (0.44) TMPRSS15MAPK14NPC1CYP1A2CYP3A4
SCHEMBL5564031 0.77 MAPK14 (0.45) MAPK14MAPK13MAPK12MAPK11
SCHEMBL27614965 0.77 ALDH1A1 (0.44) TMPRSS15MAPK14NPC1CYP1A2CYP3A4
SCHEMBL5564468 0.77 NPC1 (0.46) MAPK14NPC1RAB9ALCK

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 5 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
EP-1480976-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-12-01 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
WO-2003072577-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2003-09-04 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-20030225141-A1 THIAZOLE DERIVATIVES SLC5A1, GPR119, TAS1R1 TMPRSS15 950/4885MAPK14 3558/4885NPC1 393/4885

“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.