SCHEMBL4091103

SCHEMBL4091103

CCCCCCc1cc(-c2ccc(C)cc2)sc1CCC(=O)c1ccc(OC(C)(C)C(=O)OCC)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42
THRA P10827 6/20 0.38
THRB P10828 6/20 0.38
FBP1 P09467 4/20 0.37
LTB4R Q15722 3/20 0.36
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
RARB P10826 1/20 0.32
CTNNB1 P35222 1/20 0.32
WNT3A P56704 1/20 0.32
MGLL Q99685 1/20 0.31

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
SCHEMBL4106279 0.92 LTB4R (0.41) PPARAPPARGTHRATHRBLTB4R
SCHEMBL4106067 0.80 PPARD (0.41) PPARAPPARGFBP1
SCHEMBL2463828 0.78 PPARD (0.46) PPARAPPARG
SCHEMBL4101642 0.76 PPARD (0.39) PPARAPPARGFBP1
SCHEMBL2467843 0.76 PPARD (0.45) PPARAPPARGTHRBFBP1S1PR1
SCHEMBL4090776 0.76 PPARA (0.39) PPARAPPARGTHRATHRBFBP1
SCHEMBL2463832 0.74 PPARA (0.39) PPARAPPARGTHRATHRBFBP1
SCHEMBL12732669 0.74 PPARD (0.37) PPARAPPARG
SCHEMBL2464438 0.74 PPARA (0.43) PPARAPPARGTHRATHRBFBP1
SCHEMBL12732559 0.73 CTNNB1 (0.37) THRATHRBS1PR1S1PR3CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090240058-A1 Activator for Peroxisome Proliferator-Activating Receptor Delta NIPPON CHEMIPHAR CO., LTD. (JP) 2009-09-24 US disclosed
EP-1854784-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR ACTIVATING RECEPTOR Nippon Chemiphar Co., Ltd. (JP) 2007-11-14 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-20090240058-A1 Activator for Peroxisome Proliferator-Activating Receptor Delta PPARG, PPARA, PPARD PPARA 2/4885PPARG 1/4885THRA 123/4885

“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.