SCHEMBL6460374

SCHEMBL6460374

OB(OOC1CCCCC1)OC1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35

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
SCHEMBL1553827 0.85 CA1 (0.44) CA12CA1CA2CA9
SCHEMBL29433 0.83 CA1 (0.42) CA12CA1CA2CA9
SCHEMBL29432 0.83 CA1 (0.42) CA12CA1CA2CA9
SCHEMBL3889052 0.83 CA1 (0.42) CA12CA1CA2CA9
SCHEMBL27941342 0.80 CA12 (0.30) CA12CA1CA2CA9
SCHEMBL28076940 0.78 CA1 (0.34) CA12CA1CA2CA9
SCHEMBL27941341 0.74 CA12 (0.37) CA12CA1CA2CA9
SCHEMBL11387784 0.74 CA1 (0.37) CA12CA1CA2CA9
SCHEMBL2341384 0.72 CA1 (0.37) CA12CA1CA2CA9
SCHEMBL1014426 0.72 CA1 (0.37) CA12CA1CA2CA9

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-6855848-B2 Process for preparing bisallylboranes and nonaromatic boronic acids CLARIANT GMBH (DE) 2005-02-15 US disclosed
US-6706925-B2 REACTING A DIENE WITH SODIUM BOROHYDRIDE IN THE PRESENCE OF AN OXIDANT AND IN AN INERT SOLVENT, WITH THE BORANE GENERATED IN SITU REACTING SELECTIVELY WITH THE DIENE TO FORM THE BIS(ALLYL)BORANE CLARIANT GMBH (DE) 2004-03-16 US disclosed
US-20040039233-A1 Process for preparing bisallylboranes and nonaromatic boronic acids CLARIANT GMBH 2004-02-26 US disclosed
US-20030096995-A1 Process for preparing bisallylboranes and nonaromatic boronic acids CLARIANT GMBH 2003-05-22 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 (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-20030096995-A1 Process for preparing bisallylboranes and nonaromatic boronic acids HBS1L, CBR1, RER1 CA12 2038/4885CA1 730/4885CA2 1090/4885
US-20040039233-A1 Process for preparing bisallylboranes and nonaromatic boronic acids HBS1L, CBR1, RER1 CA12 2038/4885CA1 730/4885CA2 1090/4885

“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.