SCHEMBL4392005

SCHEMBL4392005

CC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)CC1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 8/20 0.48
HDAC1 Q13547 1/20 0.34
PRKCA P17252 6/20 0.33
DUT P33316 1/20 0.31

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
SCHEMBL16778074 1.00 TOP2A (0.48) TOP2AHDAC1PRKCADUT
SCHEMBL19464421 1.00 TOP2A (0.48) TOP2AHDAC1PRKCADUT
SCHEMBL21343867 0.90 TOP2A (0.46) TOP2AHDAC1PRKCA
SCHEMBL19632819 0.84 TOP2A (0.37) TOP2APRKCA
SCHEMBL20019772 0.84 TOP2A (0.46) TOP2AHDAC1PRKCA
SCHEMBL22700152 0.80 TOP2A (0.49) TOP2AHDAC1PRKCADUT
SCHEMBL29381478 0.78 PRKCA (0.35) TOP2APRKCA
SCHEMBL20211424 0.77 TOP2A (0.45) TOP2AHDAC1DUT
SCHEMBL6406006 0.75 TOP2A (0.46) TOP2AHDAC1DUT
SCHEMBL6334886 0.75 TOP2A (0.46) TOP2AHDAC1DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180022763-A1 Anti-Viral Compounds ABBVIE INC. (US) 2018-01-25 US disclosed
US-20170334941-A1 2',2'-DIHALO NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER EMORY UNIVERSITY 2017-11-23 US disclosed
US-9790252-B2 2-fluorinated riboses and arabinoses and methods of use and synthesis CORNELL UNIVERSITY (US) 2017-10-17 US disclosed
US-9676797-B2 Anti-viral compounds ABBVIE INC. (US) 2017-06-13 US disclosed
US-20170057981-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-03-02 US disclosed
US-20120108535-A1 2-FLUORINATED RIBOSES AND ARABINOSES AND METHODS OF USE AND SYNTHESIS CORNELL UNIVERSITY (US) 2012-05-03 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 (4 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-20170057981-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS TOP2A 950/4885HDAC1 897/4885PRKCA 1939/4885
US-20170334941-A1 2',2'-DIHALO NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER HAVCR2, DERA, EIF2AK2 TOP2A 472/4885HDAC1 2722/4885PRKCA 3728/4885
US-20180022763-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS TOP2A 950/4885HDAC1 897/4885PRKCA 1939/4885
US-20120108535-A1 2-FLUORINATED RIBOSES AND ARABINOSES AND METHODS OF USE AND SYNTHESIS SLC2A2, SLC29A2, DERA TOP2A 470/4885HDAC1 1054/4885PRKCA 4157/4885

“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.