SCHEMBL1634152

SCHEMBL1634152

COc1cccc(CC(=O)O)c1OCCCc1cn(-c2ccc(C(F)(F)F)nn2)nc1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
TAAR1 Q96RJ0 3/20 0.36
SCN9A Q15858 1/20 0.34
PPARD Q03181 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GLS O94925 1/20 0.32

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
SCHEMBL6035576 0.92 PPARG (0.40) PPARGTAAR1SCN9APPARDGLS
SCHEMBL1633509 0.91 PPARG (0.33) PPARGPPARD
SCHEMBL6035887 0.90 PPARG (0.43) PPARGTAAR1SCN9AALDH1A1
SCHEMBL6035504 0.89 PPARG (0.47) PPARGTAAR1SCN9AALDH1A1GLS
SCHEMBL6035415 0.89 PPARG (0.40) PPARGTAAR1SCN9APPARDALDH1A1
SCHEMBL6217182 0.88 PTPN1 (0.32) PPARGTAAR1SCN9AALDH1A1
SCHEMBL1633669 0.87 PPARG (0.43) PPARGTAAR1SCN9APPARD
SCHEMBL6034587 0.86 PPARG (0.43) PPARGSCN9AALDH1A1GLS
SCHEMBL6036343 0.85 PPARG (0.45) PPARGTAAR1SCN9AALDH1A1
SCHEMBL6035894 0.85 PPARG (0.44) PPARGTAAR1SCN9APPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US claimed
US-7932289-B2 Remedy for diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-04-26 US disclosed
US-20080319077-A1 Remedy for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED 2008-12-25 US disclosed
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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 (2 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-20080319077-A1 Remedy for Diabetes GPR119, GLP1R, GPR65 PPARG 38/4885TAAR1 1648/4885SCN9A 2795/4885
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 PPARG 1037/4885TAAR1 2368/4885SCN9A 2020/4885

“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.