SCHEMBL14064833

SCHEMBL14064833

CC(=O)C1CCC(CN(C)C)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.39
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
PLG P00747 1/20 0.34
PLAT P00750 1/20 0.34
LMNA P02545 1/20 0.34
MELK Q14680 11/20 0.33
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL8594838 0.83 PLG (0.54) ALOX5ALDH1A1PKMPLGPLAT
SCHEMBL8594835 0.83 PLG (0.54) ALOX5ALDH1A1PKMPLGPLAT
Hydrochloric Acid SCHEMBL2941906 0.81 PLG (0.52) ALOX5ALDH1A1PKMPLGPLAT
SCHEMBL19502954 0.81 ALOX5 (0.47) ALOX5ALDH1A1PKMPLGPLAT
Hydrochloric Acid SCHEMBL2941904 0.81 PLG (0.52) ALOX5ALDH1A1PKMPLGPLAT
SCHEMBL15342499 0.81 ALOX5 (0.47) ALOX5ALDH1A1PKMPLGPLAT
SCHEMBL13282225 0.80 ALOX5 (0.34) ALOX5ALDH1A1PKMPLGPLAT
SCHEMBL23443660 0.78 ALDH1A1 (0.32) ALOX5ALDH1A1PKMLMNA
SCHEMBL659645 0.78 ALOX5 (0.36) ALOX5ARG1ARG2
SCHEMBL1806808 0.78

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
US-8357654-B2 Multimeric CD40 ligands, method for preparing same and use thereof for preparing drugs CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-01-22 US disclosed
US-20100183642-A1 NOVEL MULTIMERIC CD40 LIGANDS, METHOD FOR PREPARING SAME AND USE THEREOF FOR PREPARING DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-07-22 US disclosed
US-20100136034-A1 NOVEL MULTIMERIC MOLECULES, A PROCESS FOR PREPARING THE SAME AND THE USE THEREOF FOR MANUFACTURING MEDICINAL DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-06-03 US disclosed
WO-2008110695-A1 NOVEL MULTIMERIC MOLECULES, METHOD FOR PREPARING SAME AND USE THEREOF IN THE PREPARATION OF DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2008-09-18 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-20100183642-A1 NOVEL MULTIMERIC CD40 LIGANDS, METHOD FOR PREPARING SAME AND USE THEREOF FOR PREPARING DRUGS CD40, CD40LG, TNFSF10 ALOX5 2913/4885ALDH1A1 4708/4885PKM 1850/4885
US-20100136034-A1 NOVEL MULTIMERIC MOLECULES, A PROCESS FOR PREPARING THE SAME AND THE USE THEREOF FOR MANUFACTURING MEDICINAL DRUGS TNFRSF1A, TNFRSF9, CD40 ALOX5 1978/4885ALDH1A1 3689/4885PKM 3030/4885

“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.