SCHEMBL6035517

SCHEMBL6035517

CC(C)c1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCOc1cccc(CCC(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.38
FFAR1 O14842 2/20 0.38
LTB4R Q15722 1/20 0.38
PPARG P37231 6/20 0.38
PPARD Q03181 6/20 0.38
PPARA Q07869 6/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.38
GCGR P47871 1/20 0.38
PTGDR Q13258 1/20 0.37
IDE P14735 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 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
SCHEMBL6036306 0.93 NR1H3 (0.39) LTB4RPPARGPPARDPPARAIDE
SCHEMBL6035465 0.90 PLA2G4B (0.39) LTB4RPPARGPPARDPPARAIDE
SCHEMBL6034481 0.88 FFAR1 (0.43) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6035872 0.87 PPARA (0.41) FFAR4FFAR1LTB4RPPARGPPARD
SCHEMBL6034677 0.87 LTB4R (0.40) FFAR4FFAR1LTB4RPPARGPPARD
SCHEMBL6036184 0.86 FFAR4 (0.45) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6035886 0.86 FFAR4 (0.45) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6035559 0.85 PPARA (0.40) PPARGPPARDPPARAIDESMN1; SMN2
SCHEMBL6035153 0.84 PPARG (0.40) FFAR4FFAR1PPARGPPARDPPARA
SCHEMBL6036205 0.84 RXRA (0.38) PPARGPPARDPPARAPTGDR2GCGR

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 1 patent. 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

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 FFAR4 195/4885FFAR1 376/4885LTB4R 1376/4885

“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.