SCHEMBL4863381

SCHEMBL4863381

COC(=O)C1(C=O)CCC(C)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
MAPT P10636 1/20 0.33
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4863377 1.00 NPSR1 (0.33) NPSR1MAPTKEAP1NFE2L2HCAR2
SCHEMBL2547049 0.83
SCHEMBL4869779 0.81 POLB (0.32) NPSR1MAPT
SCHEMBL4869772 0.81 POLB (0.32) NPSR1MAPT
SCHEMBL4864227 0.79 NPSR1 (0.47) NPSR1MAPTLMNA
SCHEMBL1971946 0.79 NPSR1 (0.42) NPSR1MAPTLMNA
SCHEMBL4872719 0.78 NPSR1 (0.45) NPSR1MAPTLMNA
SCHEMBL2305290 0.78 NPSR1 (0.45) NPSR1MAPTLMNA
SCHEMBL4870473 0.77 ALDH1A1 (0.31)
SCHEMBL6234603 0.77 ALDH1A1 (0.31)

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-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 US disclosed
WO-2005005456-A2 PEPTIDE DEFORMYLASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-01-20 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 NPSR1 3037/4885MAPT 3716/4885KEAP1 3234/4885

“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.