SCHEMBL14485394

SCHEMBL14485394

COC(=O)Cc1cc(I)c(O)c(I)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AB1 P08238 1/20 0.66
▸ THRB P10828 4/20 0.51
▸ THRA P10827 3/20 0.51
▸ PPARG P37231 3/20 0.51
▸ RXRA P19793 2/20 0.51
▸ ITGB3 P05106 1/20 0.51
▸ ITGAV P06756 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ GFER P55789 1/20 0.50
▸ CYP4F2 P78329 1/20 0.47
▸ CYP4A11 Q02928 1/20 0.47
▸ SLC7A5 Q01650 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.40
▸ PCNA P12004 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ TTR P02766 3/20 0.39
▸ MEN1 O00255 3/20 0.39

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
SCHEMBL7637293 0.90 HSP90AB1 (0.54) HSP90AB1THRBTHRAPPARGRXRA
SCHEMBL1525946 0.87 THRB (0.73) HSP90AB1THRBTHRAPPARGRXRA
SCHEMBL6647574 0.84 HSP90AB1 (0.49) HSP90AB1THRBTHRAPPARGRXRA
SCHEMBL21891794 0.83 HSP90AB1 (0.75) HSP90AB1ALDH1A1GAAGFERCYP4F2
SCHEMBL4108699 0.82 GAA (0.66) HSP90AB1THRBTHRAPPARGRXRA
SCHEMBL8204330 0.82 HSP90AB1 (0.68) HSP90AB1ALDH1A1GAAGFERCYP4F2
SCHEMBL1746736 0.81 PCNA (0.44) HSP90AB1THRBTHRAPPARGRXRA
SCHEMBL2926152 0.80 HSP90AB1 (0.66) HSP90AB1ALDH1A1GAAGFERCYP4F2
SCHEMBL8151711 0.79 HSP90AB1 (0.92) HSP90AB1ALDH1A1GAAGFERCYP4F2
SCHEMBL478058 0.79 HSP90AB1 (1.00) HSP90AB1ALDH1A1GAAGFERCYP4F2

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
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
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 HSP90AB1 1525/4885THRB 2853/4885THRA 3069/4885

“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.

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