SCHEMBL6532128

SCHEMBL6532128

COc1ccc(C[C@H](Nc2nc3cc(C)c(NC(=O)OC(C)(C)C)c(C)c3c(=O)o2)C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.47
CTRB1 P17538 2/20 0.47
PTGDR Q13258 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
PTPN1 P18031 1/20 0.38
LCK P06239 2/20 0.37
APP P05067 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
ITGA4 P13612 1/20 0.36
ITGB7 P26010 1/20 0.36

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
SCHEMBL6498011 0.87 ELANE (0.63) ELANECTRB1PTGDRPPARGPPARA
SCHEMBL6505687 0.82 ELANE (0.49) ELANECTRB1PTGDRPPARGPPARA
SCHEMBL7838428 0.81 ELANE (0.61) ELANECTRB1
SCHEMBL6496223 0.78 ELANE (0.72) ELANECTRB1PTPN1APP
SCHEMBL6499066 0.78 ELANE (0.64) ELANECTRB1PTPN1APPITGB3
SCHEMBL6497584 0.78 ELANE (0.62) ELANECTRB1PTGDR
SCHEMBL6503996 0.77 ELANE (0.60) ELANECTRB1LCKAPPITGA4
SCHEMBL6505020 0.77 ELANE (0.59) ELANECTRB1LCKAPPITGA4
SCHEMBL6498805 0.76 ELANE (0.46) ELANECTRB1PTGDRPPARGPPARA
SCHEMBL6498606 0.76 ELANE (0.59) ELANECTRB1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. (US) 2005-02-10 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-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, ACE2 ELANE 1199/4885CTRB1 1716/4885PTGDR 1914/4885

“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.