SCHEMBL6369486

SCHEMBL6369486

CC(C)(C)OC(=O)N1CCCC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.63
HDAC4 P56524 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
F10 P00742 9/20 0.52
GABRA5 P31644 1/20 0.49
PARP1 P09874 1/20 0.49
ANO1 Q5XXA6 1/20 0.48
JAK3 P52333 1/20 0.48
BTK Q06187 1/20 0.48

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
Trifluoroacetic Acid SCHEMBL6377501 0.95 USP30 (0.60) USP30HDAC4HDAC6F10GABRA5
SCHEMBL5145035 0.86 USP30 (0.82) USP30HDAC4HDAC6GABRA5PARP1
SCHEMBL5428052 0.83 F10 (0.53) USP30F10
SCHEMBL5428063 0.83 F10 (0.53) USP30F10
SCHEMBL4691128 0.83 F10 (0.53) USP30F10
SCHEMBL5437993 0.83 F10 (0.53) USP30F10
SCHEMBL5437984 0.83 F10 (0.53) USP30F10
SCHEMBL5437990 0.83 F10 (0.53) USP30F10
SCHEMBL17927199 0.83 HDAC4 (0.70) USP30HDAC4HDAC6GABRA5PARP1
SCHEMBL2467955 0.82 USP30 (0.67) USP30HDAC4HDAC6GABRA5PARP1

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-20050119266-A1 Pyrrolidine and piperidine derivatives as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-06-02 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-20050119266-A1 Pyrrolidine and piperidine derivatives as factor Xa inhibitors PEPD, SERPINE1, PRSS1 USP30 1504/4885HDAC4 1093/4885HDAC6 731/4885

“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.