SCHEMBL13359396

SCHEMBL13359396

C[C@H](OC(=O)[C@H](Oc1cccc(C(F)(F)F)c1)c1ccc(Cl)cc1)C(=O)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.57
SLC22A12 Q96S37 1/20 0.54
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 1/20 0.41
TACR1 P25103 2/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CTSS P25774 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL13324897 1.00 PPARG (0.57) PPARGSLC22A12ALDH1A1HPGDSMN1; SMN2
SCHEMBL13359395 0.93 PPARG (0.62) PPARGSLC22A12HTTMEN1KMT2A
SCHEMBL13324898 0.93 PPARG (0.62) PPARGSLC22A12HTTMEN1KMT2A
SCHEMBL3299123 0.92 PPARG (0.60) PPARGSLC22A12HPGDSMN1; SMN2HTT
SCHEMBL12189840 0.92 PPARG (0.60) PPARGSLC22A12HPGDSMN1; SMN2HTT
SCHEMBL3299728 0.92 PPARG (0.60) PPARGSLC22A12HPGDSMN1; SMN2HTT
SCHEMBL3299127 0.92 PPARG (0.60) PPARGSLC22A12HPGDSMN1; SMN2HTT
SCHEMBL16502054 0.89 PPARG (0.57) PPARGSLC22A12HTTMEN1KMT2A
SCHEMBL13374097 0.84 PPARG (0.58) PPARGSLC22A12ALDH1A1HPGDGAA
SCHEMBL14547394 0.84 ALDH1A1 (0.44) PPARGSLC22A12ALDH1A1HPGDSMN1; SMN2

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
EP-1940387-B1 PROCESS FOR THE STEREOSELECTIVE PREPARATION OF (-)-HALOFENATE AND INTERMEDIATES THEREOF METABOLEX INC (US) 2012-11-28 EP disclosed
US-7714131-B2 Process for the stereoselective preparation of (−)-halofenate and derivatives thereof METABOLEX, INC. (US) 2010-05-11 US disclosed
WO-2007038243-A1 PROCESS FOR THE STEREOSELECTIVE PREPARATION OF (-)-HALOFENATE AND INTERMEDIATES THEREOF METABOLEX, INC. (US) 2007-04-05 WO disclosed
US-20070072858-A1 Process for the stereoselective preparation of (-)-halofenate and derivatives thereof METABOLEX, INC. (US) 2007-03-29 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-20070072858-A1 Process for the stereoselective preparation of (-)-halofenate and derivatives thereof CCNY, C1S, CBR3 PPARG 1448/4885SLC22A12 2018/4885ALDH1A1 3229/4885

“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.