SCHEMBL889079

SCHEMBL889079

CC(C)(C)OC(=O)N1CCC(Nc2ncc3cc(Br)ccc3n2)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.53
PIK3CD O00329 2/20 0.51
CCNA2 P20248 11/20 0.49
CDK2 P24941 11/20 0.49
CDK7 P50613 11/20 0.49
CCNH P51946 11/20 0.49
MNAT1 P51948 11/20 0.49
CCNK O75909 9/20 0.49
CDK12 Q9NYV4 9/20 0.49
IGF1R P08069 2/20 0.46
PIK3CA P42336 1/20 0.46

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
SCHEMBL28717093 0.94 CCNK (0.49) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL29527460 0.94 CCNK (0.49) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL31460656 0.94 CCNK (0.49) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL29494812 0.94 CCNK (0.49) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL22787807 0.94 CCNK (0.49) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL20214388 0.94 ALDH1A1 (0.48) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL31460754 0.94 ALDH1A1 (0.48) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL23003082 0.92 USP30 (0.55) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL23003081 0.92 USP30 (0.55) USP30PIK3CDCCNA2CDK2CDK7
SCHEMBL23003250 0.89 CCNA2 (0.61) USP30PIK3CDCCNA2CDK2CDK7

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-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 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-20110064697-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 USP30 2645/4885PIK3CD 738/4885CCNA2 683/4885

“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.