SCHEMBL7918404

SCHEMBL7918404

C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45

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
SCHEMBL7924042 1.00 CYP3A4 (0.45) CYP3A4
SCHEMBL12762641 1.00 CYP3A4 (0.45) CYP3A4
SCHEMBL7926461 0.93 CYP3A4 (0.45) CYP3A4
SCHEMBL8204196 0.93 CYP3A4 (0.45) CYP3A4
SCHEMBL13326450 0.89 CYP3A4 (0.49) CYP3A4
SCHEMBL13318870 0.89 CYP3A4 (0.47) CYP3A4
SCHEMBL13521393 0.89
SCHEMBL15747003 0.86 HDAC1 (0.39) CYP3A4
SCHEMBL1943013 0.86 HDAC1 (0.39) CYP3A4
SCHEMBL13783718 0.86 HDAC1 (0.39) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7906513-B2 Prevent reproduction; breaking life cycle;viricides ENANTA PHARMACEUTICALS, INC. (US) 2011-03-15 US disclosed
US-7687459-B2 Arylalkoxyl hepatitis C virus protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2010-03-30 US disclosed
US-7687459-B2 Arylalkoxyl hepatitis C virus protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2010-03-30 US disclosed
US-20090041721-A1 serine protease inhibitors; interferons ENANTA PHARMACEUTICALS, INC. 2009-02-12 US disclosed
US-20090041721-A1 serine protease inhibitors; interferons ENANTA PHARMACEUTICALS, INC. 2009-02-12 US disclosed
US-20080267917-A1 N-FUNCTIONALIZED AMIDES AS HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2008-10-30 US disclosed
US-20080269228-A1 HYDRAZIDE-CONTAINING HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2008-10-30 US disclosed
WO-2008022006-A2 ARYLALKOXYL HEPATITIS C VIRUS PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2008-02-21 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 (3 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-20080267917-A1 N-FUNCTIONALIZED AMIDES AS HEPATITIS C SERINE PROTEASE INHIBITORS PRSS1, HPN, SPINT2 CYP3A4 24/4885
US-20090041721-A1 serine protease inhibitors; interferons PRSS1, SERPINB1, SPINT2 CYP3A4 69/4885
US-20080269228-A1 HYDRAZIDE-CONTAINING HEPATITIS C SERINE PROTEASE INHIBITORS HPN, SPINT2, PRSS1 CYP3A4 19/4885

“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.