SCHEMBL5348343

SCHEMBL5348343

CCOC(=O)C(C)(C)Oc1cccc([C@H]2CCCNC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.48
PPARG P37231 1/20 0.48
BCL9 O00512 9/20 0.46
CTNNB1 P35222 9/20 0.46
FBP1 P09467 1/20 0.46
ABCB11 O95342 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
HTR2A P28223 1/20 0.43
PMP22 Q01453 1/20 0.43
DRD2 P14416 1/20 0.43
DRD3 P35462 1/20 0.43

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
SCHEMBL4036258 1.00 PPARA (0.48) PPARAPPARGBCL9CTNNB1FBP1
SCHEMBL5361918 1.00 PPARA (0.48) PPARAPPARGBCL9CTNNB1FBP1
Cadaverine Tartrate SCHEMBL4028278 0.93 BCL9 (0.44) PPARAPPARGBCL9CTNNB1FBP1
Cadaverine Tartrate SCHEMBL4028282 0.93 BCL9 (0.44) PPARAPPARGBCL9CTNNB1FBP1
SCHEMBL5362032 0.88 BCL9 (0.52) PPARABCL9CTNNB1HTR2ADRD2
SCHEMBL4027810 0.88 BCL9 (0.52) PPARABCL9CTNNB1HTR2ADRD2
SCHEMBL4028234 0.88 BCL9 (0.52) PPARABCL9CTNNB1HTR2ADRD2
SCHEMBL4349760 0.88 PPARA (0.43) PPARABCL9CTNNB1DRD2DRD3
SCHEMBL5349974 0.88 BCL9 (0.52) PPARABCL9CTNNB1
SCHEMBL5352899 0.88 BCL9 (0.52) PPARABCL9CTNNB1

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
US-20070191429-A1 PPAR ACTIVATORS PFIZER INC. (US) 2007-08-16 US disclosed
US-7199243-B2 Piperidine compounds useful as PPAR activators PFIZER INC. (US) 2007-04-03 US disclosed
EP-1567493-A1 PHENYL SUBSTITUTED PIPERIDINE COMPOUNDS FOR USE AS PPAR ACTIVATORS Pfizer Products Inc. (US) 2005-08-31 EP disclosed
US-20040157885-A1 PPAR activators PFIZER INC 2004-08-12 US disclosed
WO-2004048334-A1 PHENYL SUBSTITUTED PIPERIDINE COMPOUNDS FOR USE AS PPAR ACTIVATORS PFIZER PRODUCTS INC. (US) 2004-06-10 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 (2 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-20070191429-A1 PPAR ACTIVATORS PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885BCL9 2684/4885
US-20040157885-A1 PPAR activators PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885BCL9 2684/4885

“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.