SCHEMBL1013873

SCHEMBL1013873

COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1/C=C/c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.47
HDAC1 Q13547 1/20 0.39
NAMPT P43490 1/20 0.38
ADAM17 P78536 1/20 0.37
TACR1 P25103 1/20 0.37
POLR1A O95602 1/20 0.37
APP P05067 1/20 0.37
MAPT P10636 1/20 0.37
CNR2 P34972 1/20 0.36
PPARA Q07869 1/20 0.36
USP30 Q70CQ3 1/20 0.36

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
SCHEMBL1011857 1.00 PDE4B (0.47) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL1011858 1.00 PDE4B (0.47) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL1014011 0.87 PDE4B (0.49) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL1014994 0.87 PDE4B (0.49) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL4762175 0.87 PDE4B (0.49) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL1014009 0.87 PDE4B (0.49) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL4762180 0.87 PDE4B (0.49) PDE4BHDAC1NAMPTADAM17TACR1
SCHEMBL1013429 0.82 PDE4B (0.45) PDE4BNAMPTADAM17TACR1USP30
SCHEMBL1013428 0.82 PDE4B (0.45) PDE4BNAMPTADAM17TACR1USP30
SCHEMBL1014547 0.82 PDE4B (0.45) PDE4BNAMPTADAM17TACR1USP30

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
EP-2272858-A2 HCV inhibitors comprising beta amino acids and their uses Novartis AG (CH) 2011-01-12 EP disclosed
EP-2007787-A2 HCV INHIBITORS COMPRISING BETA AMINO ACIDS AND THEIR USES Novartis AG (CH) 2008-12-31 EP disclosed
US-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 US disclosed
WO-2007121124-A2 HCV INHIBITORS COMPRISING BETA AMINO ACIDS AND THEIR USES NOVARTIS AG (CH) 2007-10-25 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-20080045530-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 PDE4B 3578/4885HDAC1 1952/4885NAMPT 1593/4885

“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.