SCHEMBL1820772

SCHEMBL1820772

CN1CCC(COC(=O)OCO[C]=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.36
HDAC1 Q13547 3/20 0.35
HDAC2 Q92769 3/20 0.35
HDAC3 O15379 2/20 0.35
NCF1 P14598 1/20 0.34
CHRM3 P20309 6/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
KDM1A O60341 1/20 0.32
BCHE P06276 1/20 0.32
JMJD6 Q6NYC1 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31

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
SCHEMBL14351435 0.80 SCN1A (0.40) CHRM3
SCHEMBL12536989 0.79 ALDH1A1 (0.46) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL1820774 0.79 HTR4 (0.36) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL1819553 0.78 NCF1 (0.45) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL1813937 0.77 CHRM3 (0.43) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL1816297 0.76 MAPT (0.41)
SCHEMBL16884955 0.76 NCF1 (0.44) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL1813936 0.76 HTR4 (0.40) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL16573666 0.75 HDAC1 (0.39) HTR4HDAC1HDAC2HDAC3NCF1
SCHEMBL16844987 0.73 NCF1 (0.43) HTR4HDAC1HDAC2HDAC3NCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005730-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS MEDIVIR AB (SE) 2013-01-03 US disclosed
EP-2499120-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS Novadex Pharmaceuticals AB (SE) 2012-09-19 EP disclosed
WO-2011056126-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS NOVADEX PHARMACEUTICALS AB (SE) 2011-05-12 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 (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-20130005730-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS REN, AGTR1, ACE HTR4 3695/4885HDAC1 575/4885HDAC2 1193/4885

“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.