SCHEMBL369974

SCHEMBL369974

COCc1c(C(C)=O)cnn1Cc1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 10/20 0.48
MCHR1 Q99705 1/20 0.44
UCHL1 P09936 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 2/20 0.40
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.40
CMA1 P23946 1/20 0.40
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
PDE1B Q01064 1/20 0.39

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
SCHEMBL369444 0.90 NPBWR1 (0.48) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL370914 0.90 NPBWR1 (0.48) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL371091 0.86 NPBWR1 (0.45) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL368793 0.86 NPBWR1 (0.45) NPBWR1MCHR1UCHL1L3MBTL1ALOX15
SCHEMBL370615 0.84 NPBWR1 (0.44) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL3357317 0.78 NPBWR1 (0.49) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL3356508 0.78 NPBWR1 (0.49) NPBWR1MCHR1UCHL1L3MBTL1NPC1
SCHEMBL3358788 0.78 NPC1 (0.58) NPBWR1MCHR1UCHL1NPC1LMNA
SCHEMBL3360069 0.76 ALDH1A1 (0.48) NPBWR1MCHR1UCHL1NPC1LMNA
SCHEMBL30739173 0.76 NPC1 (0.42) NPBWR1L3MBTL1NPC1LMNARAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS BOLEA CHRISTELLE (CH) 2013-08-15 US disclosed
EP-2595986-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2013-05-29 EP disclosed
WO-2012009009-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 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-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM2, GRM4, GRM1 NPBWR1 582/4885MCHR1 503/4885UCHL1 4390/4885

“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.