SCHEMBL21657089

SCHEMBL21657089

CC(C)C(=O)NCCC(=O)OC1CO[C@@H]2CCO[C@H]12

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.37
ACACB O00763 1/20 0.33

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
SCHEMBL18427371 1.00 BCHE (0.37) BCHEACACB
SCHEMBL18427375 1.00 BCHE (0.37) BCHEACACB
SCHEMBL17123295 0.86 BCHE (0.50) BCHE
SCHEMBL17123299 0.86 BCHE (0.50) BCHE
SCHEMBL17123308 0.86 BCHE (0.50) BCHE
SCHEMBL17123301 0.86 BCHE (0.50) BCHE
SCHEMBL21657009 0.81 BCHE (0.46) BCHE
SCHEMBL21657088 0.81 BCHE (0.46) BCHE
SCHEMBL18427376 0.80 BCHE (0.48) BCHE
SCHEMBL18427357 0.80 BCHE (0.48) BCHE

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-10550210-B2 Polyisocyanates from fused bicyclic polyols and polyurethanes therefrom IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2020-02-04 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-10550210-B2 Polyisocyanates from fused bicyclic polyols and polyurethanes therefrom PUF60, ALKBH3, ALKBH2 BCHE 1915/4885ACACB 2418/4885

“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.