SCHEMBL4576505

SCHEMBL4576505

O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Rh+4]

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32
MMP8 P22894 2/20 0.32
MMP13 P45452 2/20 0.32

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
Potassium Ion SCHEMBL6269201 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Silver SCHEMBL623539 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL4580568 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL19179127 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL789396 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL10694663 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Zinc Ion SCHEMBL4582401 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Lithium Ion SCHEMBL21069099 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL22598032 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL28573082 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7404943-B2 Applying pressurized carbon dioxide gas; recrystallization by depressurization THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-07-29 US disclosed
US-20050015936-A1 Applying pressurized carbon dioxide gas; recrystallization by depressurization NATIONAL SCIENCE FOUNDATION 2005-01-27 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-20050015936-A1 Applying pressurized carbon dioxide gas; recrystallization by depressurization CA3, S100P, CA2 THRB 4556/4885CA1 13/4885CA2 3/4885

“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.