SCHEMBL14730708

SCHEMBL14730708

CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc3[nH]c4c(c3c2)C2(CCC2)CC(C)(C)C4=O)C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 11/20 0.47
PARP1 P09874 2/20 0.43
HDAC4 P56524 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
DGAT2 Q96PD7 2/20 0.41
ANO1 Q5XXA6 1/20 0.39
RET P07949 1/20 0.39
KDR P35968 1/20 0.39
IGF1R P08069 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
SCHEMBL14730721 0.91 USP30 (0.49) USP30PARP1HDAC4HDAC6DGAT2
SCHEMBL14730775 0.86 USP30 (0.49) USP30PARP1HDAC4HDAC6DGAT2
SCHEMBL14730845 0.84 KDM5A (0.39)
SCHEMBL14731405 0.82 USP30 (0.45) USP30PARP1HDAC4HDAC6DGAT2
SCHEMBL14730849 0.81 KDM5A (0.40)
SCHEMBL14730704 0.80 KDR (0.43) KDR
SCHEMBL14730746 0.79 KDM5A (0.46)
SCHEMBL14731474 0.79 USP30 (0.47) USP30PARP1HDAC4HDAC6DGAT2
SCHEMBL14731427 0.78 USP30 (0.46) USP30PARP1HDAC4HDAC6DGAT2
SCHEMBL16248394 0.78 USP30 (0.47) USP30PARP1HDAC4HDAC6DGAT2

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 5 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
WO-2013026163-A1 HEPATITIS C INHIBITOR COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-02-28 WO 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 1713/4885PARP1 3610/4885HDAC4 2738/4885

“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.