SCHEMBL4870464

SCHEMBL4870464

CCCCCCN(C)CC(=O)Nc1ccc(C#Cc2cccc(C(=O)N[C@H](C(=O)NO)[C@@H](C)O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.41
ACACB O00763 2/20 0.39

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
SCHEMBL461781 0.92 PPARG (0.47) PPARG
SCHEMBL405993 0.91 PPARG (0.46) PPARG
SCHEMBL405237 0.88 PPARG (0.44) PPARG
SCHEMBL404902 0.84 PPARG (0.41) PPARG
SCHEMBL1109552 0.84 PPARG (0.47) PPARG
SCHEMBL1912297 0.83 PPARG (0.45) PPARG
SCHEMBL404404 0.81 PPARG (0.40) PPARG
SCHEMBL436557 0.81 ALDH1A1 (0.41)
SCHEMBL401072 0.81 PPARG (0.40) PPARG
SCHEMBL1912201 0.80 PPARG (0.44) PPARG

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-7358359-B2 Antibacterial agents UNIVERSITY OF WASHINGTON (US) 2008-04-15 US disclosed
US-20060154988-A1 Antibacterial agents UNIVERSITY OF WASHINGTON (US) 2006-07-13 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-20060154988-A1 Antibacterial agents MRPL21, SI, PGLS PPARG 1875/4885ACACB 3199/4885

“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.