SCHEMBL6035835

SCHEMBL6035835

CC(C)c1nn(-c2ncccc2C(F)(F)F)cc1CCCO

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.36
RBP4 P02753 1/20 0.36
EPHX2 P34913 1/20 0.36
PRKCB P05771 1/20 0.35
GSK3B P49841 1/20 0.35
GAA P10253 1/20 0.35
TRPV1 Q8NER1 6/20 0.35
ALDH1A1 P00352 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL6035140 0.81 EPHX2 (0.40) HSD11B1RBP4EPHX2GAAALDH1A1
SCHEMBL6309279 0.78 TRPV1 (0.36) RBP4GAATRPV1ALDH1A1HRH3
SCHEMBL6035729 0.76 NPSR1 (0.42) ALDH1A1HRH3
SCHEMBL6036226 0.75 ACACB (0.32)
SCHEMBL6034578 0.75 TLR8 (0.44)
SCHEMBL6034887 0.74 CNR1 (0.37) ALDH1A1HRH3
SCHEMBL6035150 0.74 ACACB (0.37) HRH3
SCHEMBL6034467 0.74 SMN1; SMN2 (0.41) GAAALDH1A1
SCHEMBL6034304 0.73 OGA (0.31)
SCHEMBL6035102 0.71 CNR1 (0.37) ALDH1A1HRH3

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 HSD11B1 70/4885RBP4 167/4885EPHX2 2479/4885

“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.