SCHEMBL12315474

SCHEMBL12315474

CC1(C)C=Cc2cc(C(=O)Cc3ccc(C(C)(C)C)cc3)c([18F])cc2O1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 14/20 0.47
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HSP90AA1 P07900 3/20 0.41
▸ XDH P47989 1/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.38
▸ TLR3 O15455 1/20 0.38
▸ EPAS1 Q99814 1/20 0.37

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
SCHEMBL13071290 0.84 COXFA4 (0.46) HIF1AALDH1A1CYP3A4HPGDTDP1
SCHEMBL12315467 0.84 COXFA4 (0.46) HIF1AALDH1A1CYP3A4HPGDTDP1
SCHEMBL14666188 0.77 HSP90AA1 (0.54) HIF1AALDH1A1CYP3A4HPGDTDP1
SCHEMBL12315468 0.71 PTGS1 (0.40) HIF1AALDH1A1XDHEPHX2NR1H4
SCHEMBL13071766 0.71 PTGS1 (0.40) HIF1AALDH1A1XDHEPHX2NR1H4
SCHEMBL12315469 0.70 COXFA4 (0.66) HIF1AALDH1A1TDP1TLR3EPAS1
SCHEMBL9581577 0.68 ALDH1A1 (0.43) HIF1AALDH1A1CYP3A4HPGDTDP1
SCHEMBL12315463 0.67 HIF1A (0.42) HIF1ATLR3EPAS1
SCHEMBL12315601 0.67 COXFA4 (0.41) HIF1AALDH1A1CYP3A4HPGDTDP1
SCHEMBL18245089 0.66 HIF1A (0.79) HIF1AHSP90AA1

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-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
US-7485283-B2 Contrast agents for myocardial perfusion imaging LANTHEUS MEDICAL IMAGING (US) 2009-02-03 — — 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 HIF1A 887/4885ALDH1A1 2228/4885CYP3A4 3831/4885
US-20130028837-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 HIF1A 887/4885ALDH1A1 2228/4885CYP3A4 3831/4885

“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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