SCHEMBL4030136

SCHEMBL4030136

COC(=O)N1CCC[C@@H](c2cccc(OC(C)(C)C(=O)OCc3ccccc3)c2)C1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 18/20 0.72
CTNNB1 P35222 18/20 0.72
PPARA Q07869 1/20 0.54
PDE4B Q07343 1/20 0.47

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
SCHEMBL4030141 1.00 BCL9 (0.72) BCL9CTNNB1PPARAPDE4B
SCHEMBL4031698 0.92 BCL9 (0.68) BCL9CTNNB1PPARAPDE4B
SCHEMBL4027327 0.88 BCL9 (0.86) BCL9CTNNB1PPARA
SCHEMBL4030427 0.88 BCL9 (0.88) BCL9CTNNB1PPARAPDE4B
SCHEMBL4030421 0.88 BCL9 (0.88) BCL9CTNNB1PPARAPDE4B
SCHEMBL4027999 0.87 BCL9 (0.76) BCL9CTNNB1PPARA
SCHEMBL4031309 0.85 BCL9 (0.74) BCL9CTNNB1PPARA
SCHEMBL4031303 0.85 BCL9 (0.74) BCL9CTNNB1PPARA
SCHEMBL4032213 0.84 BCL9 (0.79) BCL9CTNNB1PPARA
SCHEMBL4031114 0.83 PPARA (0.80) BCL9CTNNB1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567493-B1 PHENYL SUBSTITUTED PIPERIDINE COMPOUNDS FOR USE AS PPAR ACTIVATORS PFIZER PROD INC (US) 2009-03-18 EP disclosed
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 BCL9 2684/4885CTNNB1 2280/4885PPARA 1/4885
US-20040157885-A1 PPAR activators PPARA, PPARG, PPARD BCL9 2684/4885CTNNB1 2280/4885PPARA 1/4885

“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.