SCHEMBL14666158

SCHEMBL14666158

COc1cc(CO)cc(CO)c1CO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.50
▸ PDE4A P27815 5/20 0.48
▸ PDE4B Q07343 5/20 0.48
▸ PDE4C Q08493 5/20 0.48
▸ PDE4D Q08499 5/20 0.48
▸ PDE5A O76074 4/20 0.48
▸ PDE1A P54750 4/20 0.48
▸ PDE1B Q01064 4/20 0.48
▸ PDE3B Q13370 4/20 0.48
▸ PDE1C Q14123 4/20 0.48
▸ PDE3A Q14432 4/20 0.48
▸ ALOX15 P16050 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MMP1 P03956 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ TNKS2 Q9H2K2 1/20 0.37
▸ CA2 P00918 1/20 0.36

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
SCHEMBL13643410 0.89 PDE4A (0.46) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL13953696 0.89 PTGS2 (0.52) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL13555258 0.87 PDE4A (0.44) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL14551480 0.84 PDE4A (0.43) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL14666219 0.84 PDE4A (0.43) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL15307678 0.83 ALDH1A1 (0.51) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL12416107 0.83 GAA (0.51) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL129806 0.81 PDE4A (0.41) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL829369 0.80 KDM4E (0.52) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL9596755 0.80 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DPDE5A

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 1 patent. 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

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-20130028837-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 MAPT 4043/4885PDE4A 1363/4885PDE4B 1721/4885

“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.

Send feedback