SCHEMBL3066573

SCHEMBL3066573

COc1ccccc1COCCCOc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2OCCOc2c(F)cccc2CCNC(C)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 15/20 0.45
PDE4B Q07343 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.37

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
SCHEMBL3065065 0.93 REN (0.47) RENPDE4BCYP3A4MAPT
SCHEMBL3262296 0.93 REN (0.45) RENPDE4BCYP3A4MAPT
SCHEMBL3080682 0.92 REN (0.47) RENCYP3A4
SCHEMBL3084618 0.92 REN (0.48) RENPDE4BCYP3A4MAPT
SCHEMBL3081355 0.91 REN (0.47) RENPDE4BCYP3A4MAPT
SCHEMBL3071466 0.90 REN (0.46) RENPDE4BCYP3A4MAPT
SCHEMBL3067222 0.88 REN (0.46) RENPDE4BCYP3A4
SCHEMBL3083862 0.88 REN (0.46) RENPDE4BCYP3A4MAPT
SCHEMBL3085140 0.88 REN (0.46) RENPDE4BCYP3A4MAPT
SCHEMBL3417709 0.88 REN (0.47) RENPDE4BCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842688-B2 Organic compounds NOVARTIS PHARMA AG (CH) 2010-11-30 US disclosed
US-7790715-B2 Organic compounds NOVARTIS AG (CH) 2010-09-07 US disclosed
US-20090012055-A1 Organic compounds HEROLD PETER 2009-01-08 US disclosed
EP-1961752-A2 Piperidine Compounds Speedel Experimenta AG (CH) 2008-08-27 EP disclosed
US-20070010511-A1 Organic compounds NOVARTIS PHARMA AG (CH) 2007-01-11 US disclosed
EP-1670760-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2006-06-21 EP disclosed
WO-2005061457-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-07-07 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-20090012055-A1 Organic compounds REN, ACE, ACE2 REN 1/4885PDE4B 312/4885CYP3A4 29/4885
US-20070010511-A1 Organic compounds REN, ACE, ACE2 REN 1/4885PDE4B 312/4885CYP3A4 29/4885

“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.