SCHEMBL6035895

SCHEMBL6035895

CCOc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCOc1nn(-c2ccccc2)cc1CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 1/20 0.42
ALDH1A1 P00352 1/20 0.39
PPARD Q03181 4/20 0.39
PPARA Q07869 4/20 0.39
HPGD P15428 1/20 0.39
DGAT1 O75907 5/20 0.39
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 0.37
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
HDAC4 P56524 1/20 0.36
DRD2 P14416 1/20 0.36
TRPA1 O75762 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
SCHEMBL6034670 0.96 KDM4E (0.42) KDM4ESMN1; SMN2LMNAALDH1A1PPARD
SCHEMBL6035939 0.90 SMN1; SMN2 (0.44) KDM4ESMN1; SMN2LMNAPPARDPPARA
SCHEMBL6035813 0.89 SMN1; SMN2 (0.47) KDM4ESMN1; SMN2LMNAPPARDPPARA
SCHEMBL6217053 0.88 SMN1; SMN2 (0.42) KDM4ESMN1; SMN2LMNAPPARDPPARA
SCHEMBL6034593 0.86 HCRTR1 (0.37) KDM4ESMN1; SMN2LMNAALDH1A1PPARD
SCHEMBL6035903 0.86 SMN1; SMN2 (0.41) KDM4ESMN1; SMN2LMNAPPARDPPARA
SCHEMBL1633759 0.86 HCRTR1 (0.36) KDM4ESMN1; SMN2LMNAALDH1A1PPARD
SCHEMBL6035924 0.85 SMN1; SMN2 (0.39) KDM4ESMN1; SMN2LMNAALDH1A1PPARD
SCHEMBL6036232 0.85 SMN1; SMN2 (0.40) KDM4ESMN1; SMN2LMNAPPARDPPARA
SCHEMBL6035760 0.85 SMN1; SMN2 (0.43) KDM4ESMN1; SMN2LMNAPPARDPPARA

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
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 (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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 KDM4E 509/4885SMN1; SMN2 4408/4885LMNA 1816/4885

“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.