SCHEMBL14485265

SCHEMBL14485265

NCc1cc(I)c(Oc2ccc(O)cc2)c(I)c1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PCNA P12004 13/20 0.64
LIG1 P18858 1/20 0.64
TAAR5 O14804 1/20 0.55
TAAR1 Q96RJ0 1/20 0.55

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
SCHEMBL13886598 0.87 TAAR5 (0.68) PCNALIG1TAAR5TAAR1
SCHEMBL4005004 0.84 PCNA (0.66) PCNALIG1TAAR5TAAR1
SCHEMBL16124480 0.84 PCNA (0.63) PCNALIG1TAAR5TAAR1
SCHEMBL16124416 0.82 PCNA (0.80) PCNALIG1
SCHEMBL14484721 0.82 PCNA (0.80) PCNALIG1
SCHEMBL14484719 0.82 PCNA (0.80) PCNALIG1
SCHEMBL4449390 0.81 PCNA (0.74) PCNALIG1
SCHEMBL16126016 0.81 PCNA (0.65) PCNALIG1TAAR5TAAR1
SCHEMBL14264010 0.80 PCNA (0.67) PCNALIG1TAAR5TAAR1
SCHEMBL22382794 0.80 PCNA (0.67) PCNALIG1TAAR5TAAR1

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-20140288077-A1 SUBSTITUTED 4-PHENOXYPHENOL ANALOGS AS MODULATORS OF PROLIFERATING CELL NUCLEAR ANTIGEN ACTIVITY ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2014-09-25 US disclosed
US-20140288077-A1 SUBSTITUTED 4-PHENOXYPHENOL ANALOGS AS MODULATORS OF PROLIFERATING CELL NUCLEAR ANTIGEN ACTIVITY ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2014-09-25 US disclosed
WO-2013006734-A1 SUBSTITUTED 4-PHENOXYPHENOL ANALOGS AS MODULATORS OF PROLIFERATING CELL NUCLEAR ANTIGEN ACTIVITY ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2013-01-10 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-20140288077-A1 SUBSTITUTED 4-PHENOXYPHENOL ANALOGS AS MODULATORS OF PROLIFERATING CELL NUCLEAR ANTIGEN ACTIVITY MKI67, PCNA, PCLAF PCNA 2/4885LIG1 1098/4885TAAR5 4442/4885

“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.