SCHEMBL1034041

SCHEMBL1034041

CCOC(=O)COc1ccc(C(=O)CCc2sc3cc(C(F)(F)F)ccc3c2C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43
PPARD Q03181 12/20 0.40
PPARG P37231 6/20 0.40
PPARA Q07869 6/20 0.40
ABCB1 P08183 1/20 0.38
F9 P00740 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
FFAR4 Q5NUL3 2/20 0.35
FFAR1 O14842 1/20 0.35
FFAR2 O15552 1/20 0.35

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
SCHEMBL1034264 0.93 ESR1 (0.43) ESR1PPARDPPARGPPARAABCB1
SCHEMBL1032851 0.90 PPARD (0.47) PPARDPPARGPPARA
SCHEMBL1031595 0.90 ESR1 (0.40) ESR1PPARDPPARGPPARAABCB1
SCHEMBL1034038 0.85 ABCB1 (0.46) ESR1ABCB1F9
SCHEMBL20292499 0.85 FBP1 (0.38) PPARDPPARGPPARAMRGPRX4
SCHEMBL1035193 0.83 PPARD (0.47) PPARDPPARGPPARA
SCHEMBL1031757 0.82 PPARD (0.46) PPARDPPARGPPARA
SCHEMBL1034982 0.81 BCL2L1 (0.37) ESR1FFAR4
SCHEMBL1034187 0.81 PPARD (0.40) ESR1PPARDPPARGPPARAF9
SCHEMBL1031604 0.80 PPARD (0.45) PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424917-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR Nippon Chemiphar Co., Ltd. (JP) 2019-01-09 EP disclosed
EP-2277874-B1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR NIPPON CHEMIPHAR CO (JP) 2018-06-27 EP disclosed
US-8648208-B2 Activating agent for peroxisome proliferator activated receptor NIPPON CHEMIPHAR CO. LTD. (JP) 2014-02-11 US disclosed
US-20110098480-A1 ACTIVATING AGENT FOR PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR NIPPON CHEMIPHAR CO. LTD. (JP) 2011-04-28 US disclosed
EP-2277874-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR Nippon Chemiphar Co., Ltd. (JP) 2011-01-26 EP 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-20110098480-A1 ACTIVATING AGENT FOR PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR PPARA, PPARG, PPARD ESR1 240/4885PPARD 3/4885PPARG 2/4885

“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.