SCHEMBL16248396

SCHEMBL16248396

CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc3c(c2)C2=C(C3)C(=O)CCCC23CC3)C1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 11/20 0.48
HDAC4 P56524 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
DGAT2 Q96PD7 2/20 0.42
GPR119 Q8TDV5 2/20 0.39
ANO1 Q5XXA6 1/20 0.39
CRBN Q96SW2 1/20 0.39
PARP1 P09874 1/20 0.38

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
SCHEMBL16248394 0.86 USP30 (0.47) USP30HDAC4HDAC6DGAT2ANO1
SCHEMBL14730775 0.77 USP30 (0.49) USP30HDAC4HDAC6DGAT2ANO1
SCHEMBL3720765 0.70 USP30 (0.65) USP30HDAC4HDAC6PARP1
SCHEMBL26554550 0.70 HDAC4 (0.62) USP30HDAC4HDAC6DGAT2PARP1
SCHEMBL889094 0.70 HDAC4 (0.62) USP30HDAC4HDAC6DGAT2PARP1
SCHEMBL29437052 0.70 HDAC4 (0.62) USP30HDAC4HDAC6DGAT2PARP1
SCHEMBL26402532 0.70 NR1H2 (0.58) USP30HDAC4HDAC6
SCHEMBL4921150 0.70 USP30 (0.71) USP30HDAC4HDAC6PARP1
SCHEMBL4924196 0.70 USP30 (0.71) USP30HDAC4HDAC6PARP1
SCHEMBL994594 0.70 USP30 (0.71) USP30HDAC4HDAC6PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340539-B2 Hepatitis C inhibitor compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-17 US disclosed
US-9340539-B2 Hepatitis C inhibitor compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-17 US disclosed
US-20140343077-A1 HEPATITIS C INHIBITOR COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-20 US disclosed
US-20140343077-A1 HEPATITIS C INHIBITOR COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-20 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-20140343077-A1 HEPATITIS C INHIBITOR COMPOUNDS HCCS, C1R, HAVCR2 USP30 1713/4885HDAC4 2738/4885HDAC6 1799/4885

“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.