SCHEMBL3372052

SCHEMBL3372052

COC(=O)C1CC(OS(=O)(=O)c2ccc(Br)cc2)CN1C(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 13/20 0.42
MMP2 P08253 1/20 0.38
CYP3A4 P08684 1/20 0.37
MCL1 Q07820 2/20 0.37

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
SCHEMBL15483922 1.00 ELANE (0.42) ELANEMMP2CYP3A4MCL1
SCHEMBL15258574 1.00 ELANE (0.42) ELANEMMP2CYP3A4MCL1
SCHEMBL10221213 1.00 ELANE (0.42) ELANEMMP2CYP3A4MCL1
SCHEMBL15258576 0.92 ELANE (0.45) ELANEMCL1
SCHEMBL10221208 0.92 ELANE (0.45) ELANEMCL1
SCHEMBL19650261 0.92 ELANE (0.45) ELANEMCL1
SCHEMBL8135578 0.91 ELANE (0.42) ELANEMMP2CYP3A4
SCHEMBL8131130 0.91 ELANE (0.44) ELANECYP3A4MCL1
SCHEMBL4449192 0.90 HDAC8 (0.39) ELANEMMP2MCL1
SCHEMBL3050430 0.90 HDAC8 (0.39) ELANEMMP2MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809267-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2014-08-19 US disclosed
US-20140051626-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-02-20 US disclosed
US-8513186-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-08-20 US disclosed
EP-2162432-A2 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2010-03-17 EP disclosed
US-20090186869-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2009-07-23 US disclosed
WO-2009005677-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2009-01-08 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 (2 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-20090186869-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 ELANE 1237/4885MMP2 3149/4885CYP3A4 1770/4885
US-20140051626-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ELANE 1237/4885MMP2 3149/4885CYP3A4 1770/4885

“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.