SCHEMBL5569762

SCHEMBL5569762

Cc1ccccc1C(=O)c1cnc(NCCCNC(=O)c2cccc(F)c2)s1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
NPY1R P25929 1/20 0.44
RECQL P46063 1/20 0.44
NPY2R P49146 1/20 0.44
MAPK14 Q16539 3/20 0.44
LCK P06239 1/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
NAMPT P43490 1/20 0.42
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 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
SCHEMBL5569495 0.91 MAPK13 (0.45) MAPK14NAMPTMAPK13MAPK12MAPK11
SCHEMBL5568257 0.90 KMT2A (0.43) KDM4ENPY1RRECQLNPY2RMAPK14
SCHEMBL5569114 0.90 NAMPT (0.41) KDM4ENPY1RRECQLNPY2RMAPK14
SCHEMBL5564268 0.90 NPC1 (0.47) MAPK14LCKMEN1KMT2AMAPK13
SCHEMBL5564672 0.89 NPC1 (0.47) MAPK14LCKKMT2AMAPK13MAPK12
SCHEMBL5563936 0.89 MAPK13 (0.55) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5569093 0.88 ALDH1A1 (0.43) MAPK14ALDH1A1NAMPTMAPK13MAPK12
SCHEMBL5565911 0.87 KDM4E (0.43) KDM4ENPY1RRECQLNPY2RMAPK14
SCHEMBL5564064 0.85 BRD4 (0.45) MAPK14KMT2AMAPK13MAPK12MAPK11
SCHEMBL5569959 0.84 MEN1 (0.42) KDM4ENPY1RRECQLNPY2RMAPK14

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 KDM4E 2294/4885NPY1R 94/4885RECQL 3283/4885

“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.