SCHEMBL6791248

SCHEMBL6791248

CC(C)C(Br)OC1CCCOC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.30

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
SCHEMBL10739850 0.91 ACACB (0.31) ACACB
SCHEMBL18347904 0.82 ACACB (0.33) ACACB
SCHEMBL18347909 0.82 ACACB (0.33) ACACB
SCHEMBL12701955 0.82 ACACB (0.33) ACACB
SCHEMBL10396015 0.78 ACACB (0.33) ACACB
SCHEMBL1467283 0.76 ACACB (0.30) ACACB
SCHEMBL6254504 0.74 PDE4A (0.33)
SCHEMBL3821465 0.73 ACACB (0.32) ACACB
SCHEMBL7453924 0.73 ACACB (0.32) ACACB
SCHEMBL1984125 0.71 ACACB (0.30) ACACB

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-20040058969-A1 Novel epothilone derivatives, method for the preparation thereof and their pharmaceutical use SCHERING AG (DE) 2004-03-25 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-20040058969-A1 Novel epothilone derivatives, method for the preparation thereof and their pharmaceutical use TUBA1C, TUBB1, MALT1 ACACB 1802/4885

“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.