SCHEMBL4552597

SCHEMBL4552597

C=C(Oc1cc(OC)c(OCc2ccccc2)c(OC)c1)c1ccc2c(c1)C=CC(C)(C)O2

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
COXFA4 O00483 1/20 0.54
HIF1A Q16665 6/20 0.41
EPAS1 Q99814 4/20 0.41
EP300 Q09472 1/20 0.41
TLR3 O15455 1/20 0.40

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
SCHEMBL3456384 0.82 COXFA4 (0.62) COXFA4HIF1A
SCHEMBL12315582 0.77 HIF1A (0.51) COXFA4HIF1AEPAS1EP300
SCHEMBL6936669 0.74 CA2 (0.54) HIF1AEPAS1TLR3
SCHEMBL10507725 0.74 TLR3 (0.64) HIF1AEPAS1EP300TLR3
SCHEMBL12315460 0.74 COXFA4 (0.67) COXFA4HIF1AEPAS1
SCHEMBL12677582 0.73 COXFA4 (0.63) COXFA4HIF1AEPAS1
SCHEMBL10752810 0.71 TLR3 (0.70) HIF1AEPAS1TLR3
SCHEMBL14139185 0.70 COXFA4 (1.00) COXFA4HIF1AEPAS1
SCHEMBL12315552 0.70 COXFA4 (0.74) COXFA4HIF1A
SCHEMBL8884766 0.69 RAB9A (0.51) COXFA4

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 2119/4885HIF1A 887/4885EPAS1 852/4885
US-20130028837-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 COXFA4 2119/4885HIF1A 887/4885EPAS1 852/4885

“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.