SCHEMBL4864220

SCHEMBL4864220

CCCCC1CC(C=NOCc2ccccc2)(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.38
CYP3A4 P08684 3/20 0.37
MAPK1 P28482 3/20 0.37
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2D6 P10635 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
LMNA P02545 2/20 0.35
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
NAMPT P43490 1/20 0.34
MMP1 P03956 1/20 0.33
MMP3 P08254 1/20 0.33

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
SCHEMBL4864213 1.00 CETP (0.38) CETPCYP3A4MAPK1ALDH1A1TDP1
SCHEMBL4868098 0.91 ADAM17 (0.36) CETPCYP3A4MAPK1ALDH1A1TDP1
SCHEMBL6237225 0.80 HTR2C (0.39) ALDH1A1TSHRHTTLMNAPPARG
SCHEMBL4871791 0.80 HTR2C (0.39) ALDH1A1TSHRHTTLMNAPPARG
SCHEMBL4871801 0.80 HTR2C (0.39) ALDH1A1TSHRHTTLMNAPPARG
SCHEMBL4866782 0.80 METAP2 (0.36) ALDH1A1LMNAPPARGPPARANAMPT
SCHEMBL4866777 0.80 METAP2 (0.36) ALDH1A1LMNAPPARGPPARANAMPT
SCHEMBL4866773 0.80 METAP2 (0.36) ALDH1A1LMNAPPARGPPARANAMPT
SCHEMBL4866785 0.80 METAP2 (0.36) ALDH1A1LMNAPPARGPPARANAMPT
SCHEMBL4863361 0.77 LMNA (0.41) MAPK1ALDH1A1TDP1L3MBTL1LMNA

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 CETP 856/4885CYP3A4 4649/4885MAPK1 3587/4885

“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.