SCHEMBL5742411

SCHEMBL5742411

COC(=O)Cc1ccc(Oc2ccc(O)cc2)c(I)c1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR5 O14804 1/20 0.59
TAAR1 Q96RJ0 1/20 0.59
PCNA P12004 7/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
GFER P55789 1/20 0.47
HSP90AB1 P08238 1/20 0.46
NR1I2 O75469 1/20 0.46
PPARG P37231 1/20 0.46
AGTR2 P50052 1/20 0.46
MEN1 O00255 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL13886677 0.86 TAAR5 (0.43) TAAR5TAAR1ALDH1A1GAAGFER
SCHEMBL17141553 0.85 TAAR5 (0.63) TAAR5TAAR1PCNAGAANR1I2
SCHEMBL5742819 0.84 TAAR5 (0.59) TAAR5TAAR1PCNANR1I2PPARG
SCHEMBL27293661 0.83 TAAR5 (0.66) TAAR5TAAR1PCNANR1I2PPARG
SCHEMBL5741869 0.83 PCNA (0.62) PCNAHSP90AB1PPARG
SCHEMBL5098708 0.81 GAA (0.51) ALDH1A1GAAGFERHSP90AB1MEN1
SCHEMBL12866370 0.79 NR1I2 (0.62) TAAR5TAAR1PCNAALDH1A1NR1I2
SCHEMBL13886734 0.77 TAAR5 (0.68) TAAR5TAAR1PCNAALDH1A1GFER
SCHEMBL4108699 0.76 GAA (0.66) PCNAALDH1A1GAAGFERHSP90AB1
SCHEMBL3858898 0.76 GAA (0.61) ALDH1A1GAAGFERHSP90AB1BLM

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-1383729-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2006-04-19 EP disclosed
US-20040267015-A1 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORPORATION 2004-12-30 US disclosed
EP-1383729-A1 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2004-01-28 EP disclosed
WO-2002081426-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-17 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-20040267015-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 TAAR5 4186/4885TAAR1 4309/4885PCNA 1541/4885

“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.