SCHEMBL2354176

SCHEMBL2354176

C=C(C(=O)OCC)C1CCN(OCc2ccccc2)C(=C=O)C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.40
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTT P42858 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
EGFR P00533 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7448545 0.82 SMN1; SMN2 (0.53) L3MBTL1SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL10871959 0.78 L3MBTL1 (0.42) L3MBTL1NPC1MEN1KMT2AEGFR
SCHEMBL2354166 0.77 SMN1; SMN2 (0.67) L3MBTL1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL27569281 0.76 SMN1; SMN2 (0.44) L3MBTL1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL4671484 0.75 SMN1; SMN2 (0.60) L3MBTL1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL10724692 0.73 L3MBTL1 (0.37) L3MBTL1ALDH1A1
SCHEMBL9204131 0.73 CTSL (0.36) MEN1KMT2AALDH1A1
SCHEMBL4671331 0.72 SMN1; SMN2 (0.52) L3MBTL1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL9796122 0.72 ALDH1A1 (0.38) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1
SCHEMBL8899910 0.71 GAA (0.36) L3MBTL1SMN1; SMN2NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319366-A1 Plasma Carboxypeptidase B Inhibitors BUCKMAN BRAD (US) 2011-12-29 US disclosed
US-8008325-B2 Plasma carboxypeptidase B inhibitors BAYER SCHERING PHARMA AG (DE) 2011-08-30 US disclosed
EP-2204373-A1 Phosphonic acid as Plasma Carboxypeptidase B Inhibitors Bayer Schering Pharma Aktiengesellschaft (DE) 2010-07-07 EP disclosed
US-7528173-B2 Plasma carboxypeptidase B inhibitors SCHERING AKTIENGESELLSHAFT (DE) 2009-05-05 US disclosed
US-20090093520-A1 PLASMA CARBOXYPEPTIDASE B INHIBITORS BUCKMAN BRAD 2009-04-09 US disclosed
US-20060247213-A1 Plasma carboxypeptidase b inhibitors SCHERING AKTIENGESELLSCHAFT (DE) 2006-11-02 US disclosed
EP-1497300-A2 PLASMA CARBOXYPEPTIDASE B INHIBITORS Schering Aktiengesellschaft (DE) 2005-01-19 EP disclosed
WO-2003080631-A2 PLASMA CARBOXYPEPTIDASE B INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2003-10-02 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 (3 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-20110319366-A1 Plasma Carboxypeptidase B Inhibitors CPB1, CPB2, CPA1 L3MBTL1 1928/4885SMN1; SMN2 4113/4885NPC1 1299/4885
US-20090093520-A1 PLASMA CARBOXYPEPTIDASE B INHIBITORS CPB1, CPB2, CPA1 L3MBTL1 1928/4885SMN1; SMN2 4113/4885NPC1 1299/4885
US-20060247213-A1 Plasma carboxypeptidase b inhibitors CPB1, CPB2, CPA1 L3MBTL1 1545/4885SMN1; SMN2 4015/4885NPC1 1163/4885

“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.