SCHEMBL4432826

SCHEMBL4432826

COc1cc(CC(=CI)c2ccc3c(c2)C=CC(C)(C)O3)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ COXFA4 O00483 2/20 0.67
▸ HSP90AA1 P07900 4/20 0.56
▸ ODC1 P11926 1/20 0.47
▸ HIF1A Q16665 12/20 0.47
▸ EPAS1 Q99814 2/20 0.44

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
SCHEMBL12315561 1.00 COXFA4 (0.67) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL4432821 1.00 COXFA4 (0.67) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL12315565 0.90 COXFA4 (0.64) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL14666256 0.86 COXFA4 (0.51) COXFA4HSP90AA1HIF1AEPAS1
SCHEMBL12315552 0.86 COXFA4 (0.74) COXFA4HSP90AA1HIF1A
SCHEMBL12315460 0.84 COXFA4 (0.67) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL3457889 0.83 COXFA4 (0.56) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL3457885 0.83 COXFA4 (0.56) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL14139182 0.82 COXFA4 (0.65) COXFA4HSP90AA1ODC1HIF1AEPAS1
SCHEMBL14139181 0.82 COXFA4 (0.65) COXFA4HSP90AA1ODC1HIF1AEPAS1

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-20130028837-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING LANTHEUS MEDICAL IMAGING, INC. (US) 2013-01-31 — — US disclosed
US-8263042-B2 Contrast agents for myocardial perfusion imaging LANTHEUS MEDICAL IMAGING, INC. (US) 2012-09-11 — — US disclosed
US-20090104118-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING CITIZENS BANK, N.A. 2009-04-23 — — US 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 (2 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-20090104118-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 COXFA4 2119/4885HSP90AA1 1970/4885ODC1 4756/4885
US-20130028837-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 COXFA4 2119/4885HSP90AA1 1970/4885ODC1 4756/4885

“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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