SCHEMBL5667693

SCHEMBL5667693

C=CCOC(=O)N1CC(=O)C=C(O)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 10/20 0.42
MAPK1 P28482 2/20 0.38
RAB9A P51151 2/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
CYP19A1 P11511 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MDM2 Q00987 1/20 0.33
KMT2A Q03164 1/20 0.33
FAAH O00519 1/20 0.33
GPR119 Q8TDV5 1/20 0.32
APP P05067 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
SCHEMBL29306874 0.79 ERN1 (0.42) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL10548337 0.78 LMNA (0.40) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL10548331 0.72 ERN1 (0.40) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL9383271 0.70 ERN1 (0.49) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL9191402 0.70 LMNA (0.42) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL8924794 0.70 LMNA (0.42) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL597800 0.69 LMNA (0.45) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL6686807 0.68 ERN1 (0.51) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL4195614 0.68 LMNA (0.46) ERN1MAPK1RAB9ALMNACYP3A4
SCHEMBL5670115 0.67 ADRA1D (0.41) MAPK1RAB9ALMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1476427-A4 PEPTIDE BETA-STRAND MIMICS BASED ON 1,2-DIHYDRO-3(6H)-PYRIDINONE UNIV CALIFORNIA (US) 2006-04-19 EP disclosed
US-20050043538-A1 Peptide beta-strand mimics based on 1,2-dihydro-3(6H)-pyridinone THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-02-24 US disclosed
EP-1476427-A2 PEPTIDE BETA-STRAND MIMICS BASED ON 1,2-DIHYDRO-3(6H)-PYRIDINONE The Regents of the University of California (US) 2004-11-17 EP disclosed
US-20030073721-A1 Peptide beta-strand mimics based on 1,2-dihydro-3(6H)-pyridinone THE REGENTS OF THE UNIVERSITY OF CALIFORNIA, A CALIFORNIA CORPORATION (US) 2003-04-17 US disclosed
WO-2002099045-A2 PEPTIDE BETA-STRAND MIMICS BASED ON 1,2-DIHYDRO-3(6H)-PYRIDINONE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-12-12 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 (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-20030073721-A1 Peptide beta-strand mimics based on 1,2-dihydro-3(6H)-pyridinone IAPP, VIP, APP ERN1 3229/4885MAPK1 3733/4885RAB9A 2338/4885
US-20050043538-A1 Peptide beta-strand mimics based on 1,2-dihydro-3(6H)-pyridinone IAPP, APP, VIP ERN1 2789/4885MAPK1 3524/4885RAB9A 2372/4885

“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.