SCHEMBL4345540

SCHEMBL4345540

C/C(=C\CCCCO[Si](C)(C)C(C)(C)C)CO

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 7/20 0.33
DUT P33316 1/20 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
SCHEMBL4345547 1.00 BTN3A1 (0.33) BTN3A1DUT
SCHEMBL8849600 0.95 BTN3A1 (0.34) BTN3A1DUT
SCHEMBL8947094 0.95 BTN3A1 (0.34) BTN3A1DUT
SCHEMBL15975343 0.84 DUT (0.34) DUT
SCHEMBL31399585 0.83 DUT (0.33) DUT
SCHEMBL31399609 0.83 DUT (0.33) DUT
SCHEMBL26628151 0.82 DUT (0.31) DUT
SCHEMBL8620154 0.80 DUT (0.32) DUT
SCHEMBL8620159 0.80 DUT (0.32) DUT
SCHEMBL1691509 0.79 BTN3A1 (0.35) BTN3A1DUT

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-7612213-B2 (E)-ethyl 7-hydroxy-2-methyl-2-heptenate; (3E, 5E)-tert-butyl-9-(tert-butyldimethylsiloxy)-2-[(E)-ethylid ene]-4-methylnona-3,5-dienate RIKEN (JP) 2009-11-03 US disclosed
US-20050209463-A1 Novel compound having antitumor activity and process for producing the same RIKEN (JP) 2005-09-22 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-20050209463-A1 Novel compound having antitumor activity and process for producing the same MCL1, MYC, HCCS BTN3A1 4119/4885DUT 501/4885

“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.