SCHEMBL4598217

SCHEMBL4598217

CCC(OCCO)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 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
SCHEMBL25045811 0.89 CA1 (0.39) CA1CA2ALOX15
SCHEMBL11138013 0.81 CA1 (0.45) CA1CA2ALDH1A1
SCHEMBL7367907 0.81 DDAH1 (0.33) CA1CA2ALOX15
SCHEMBL2557758 0.80 SMN1; SMN2 (0.38) CA2ALDH1A1
SCHEMBL6395180 0.79
SCHEMBL28396026 0.79 ACHE (0.32) ALDH1A1
SCHEMBL27447790 0.77 ALDH1A1 (0.37) ALDH1A1ALOX15
SCHEMBL1259256 0.76 CA1 (0.34) CA1CA2ALOX15
SCHEMBL23850372 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL23230292 0.74 CA1 (0.33) CA1CA2ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255088-A1 DIBENZO[b,f][1,4]OXAZAPINE COMPOUNDS PROTOCELL THERAPEUTICS INC. 2008-10-16 US disclosed
US-4325973-A Hydroxyalkyl amides as fungicides to eumycotina in phanerogamia plant life GAF CORPORATION (US) 1982-04-20 US disclosed
US-4195096-A NONTOXIC, BIODEGRADABLE GAF CORPORATION (US) 1980-03-25 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-20080255088-A1 DIBENZO[b,f][1,4]OXAZAPINE COMPOUNDS DBH, DRD4, PSEN1 CA1 3287/4885CA2 4707/4885ALDH1A1 668/4885

“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.