SCHEMBL5564650

SCHEMBL5564650

Cc1ccsc1C(=O)c1cnc(NCCC(N)=O)s1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 2/20 0.44
MAPK14 Q16539 6/20 0.43
PIK3CG P48736 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
PPARG P37231 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
GSK3B P49841 1/20 0.39
LCK P06239 2/20 0.39
PKM P14618 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL5564654 0.86 MAPK14 (0.41) TMPRSS15MAPK14NPC1RAB9APPARG
SCHEMBL5567861 0.80 MAPK14 (0.46) MAPK14NPC1RAB9ACYP1A2CYP3A4
SCHEMBL27614968 0.78 ALDH1A1 (0.41) TMPRSS15MAPK14LCKPKMCYP1A2
SCHEMBL5564286 0.78 SIRT3 (0.45) TMPRSS15MAPK14PIK3CGLCK
SCHEMBL5569873 0.78 TMPRSS15 (0.44) TMPRSS15MAPK14PIK3CGNPC1RAB9A
SCHEMBL5564231 0.77 MAPK13 (0.63) TMPRSS15MAPK14NPC1RAB9APPARG
SCHEMBL5569211 0.76 RAB9A (0.47) MAPK14NPC1RAB9ALCKCYP1A2
SCHEMBL5568753 0.76 P2RX7 (0.45) TMPRSS15MAPK14PIK3CG
SCHEMBL5568866 0.75 NPC1 (0.43) NPC1RAB9APKM
SCHEMBL5569154 0.74 MAPK14 (0.46) MAPK14

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 3558/4885PIK3CG 3309/4885

“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.