SCHEMBL5010628

SCHEMBL5010628

O=C(NCc1ccccc1C(F)(F)F)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGES O14684 12/20 0.47
HSD17B13 Q7Z5P4 2/20 0.45
EPHX2 P34913 4/20 0.44
PPARG P37231 2/20 0.42
CCR1 P32246 1/20 0.42

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
SCHEMBL5008267 0.90 PPARG (0.45) HSD17B13PPARG
SCHEMBL5010568 0.90 NPC1 (0.46) PPARG
SCHEMBL5009713 0.88 NTRK1 (0.44) PPARG
SCHEMBL5010356 0.87 PPARG (0.50) PPARG
SCHEMBL14587617 0.87 HSD17B13 (0.47) PTGESHSD17B13PPARG
SCHEMBL5013589 0.86 PPARG (0.41) PTGESPPARG
SCHEMBL5010405 0.85 PPARG (0.59) PPARG
SCHEMBL5008235 0.85 PPARG (0.44) PTGESPPARG
SCHEMBL5013524 0.85 PPARG (0.41) PTGESPPARG
SCHEMBL5012144 0.85 PPARG (0.52) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP 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 PTGES 4266/4885HSD17B13 243/4885EPHX2 3324/4885

“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.