SCHEMBL14587641

SCHEMBL14587641

CC(C)(C)OC(=O)NCc1ccnc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.41
NTRK1 P04629 7/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PTGES O14684 1/20 0.37
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL14587772 0.84 ALDH1A1 (0.43) PPARGNTRK1ALDH1A1
SCHEMBL14587693 0.83 RAB9A (0.46) PPARGNTRK1ALDH1A1PTGESHTT
SCHEMBL14587735 0.83 NTRK1 (0.54) PPARGNTRK1ALDH1A1HTTRECQL
SCHEMBL14587723 0.80 PPARG (0.47) PPARGHTT
SCHEMBL14587722 0.80 NTRK1 (0.54) PPARGNTRK1ALDH1A1
SCHEMBL14587847 0.79 PPARG (0.44) PPARGNTRK1ALDH1A1HTTRECQL
SCHEMBL5012182 0.79 PPARG (0.56) PPARGHDAC1HDAC6
SCHEMBL13933572 0.79 POLB (0.34) PPARGNTRK1HTTRECQL
SCHEMBL5010840 0.79 NR1H4 (0.53) PPARGHDAC6NR1H4
SCHEMBL14587849 0.78 PPARG (0.43) PPARGNTRK1ALDH1A1PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL PPARG 706/4885NTRK1 4549/4885ALDH1A1 1278/4885

“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.