SCHEMBL7205689

SCHEMBL7205689

COC(=O)N(C(=O)[C@@H](N)C(C)C)C(=O)[C@@H]1CCCN1[C@H](C(=O)c1nn(-c2ccccc2C(F)(F)F)c(=O)o1)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MGLL Q99685 1/20 0.30

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
SCHEMBL7201776 0.90
SCHEMBL7203915 0.89 ADRA1D (0.33)
SCHEMBL7201093 0.88 DPP4 (0.30) CYP1A2CYP2C9CYP2C19
SCHEMBL7200171 0.87 CNR2 (0.32) CYP2D6CYP2C9CYP2C19
SCHEMBL7206508 0.85 CNR1 (0.30)
SCHEMBL7198867 0.85 ABHD16A (0.34)
SCHEMBL7199785 0.85 NR3C2 (0.31)
SCHEMBL7201823 0.85 LGMN (0.32)
SCHEMBL7200114 0.84
SCHEMBL7205726 0.84 MEN1 (0.30)

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-20030087831-A1 1,3,4-Oxadiazolin-2-one derivatives and drugs containing these derivatives as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-08 US claimed
EP-1234834-A1 1,3,4-OXADIAZOLIN-2-ONE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-08-28 EP claimed
US-20030087831-A1 1,3,4-Oxadiazolin-2-one derivatives and drugs containing these derivatives as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-08 US disclosed
EP-1234834-A1 1,3,4-OXADIAZOLIN-2-ONE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-08-28 EP 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-20030087831-A1 1,3,4-Oxadiazolin-2-one derivatives and drugs containing these derivatives as the active ingredient SERPINB1, ELANE, MMP8 SCN9A 4639/4885CYP1A2 2166/4885CYP3A4 1673/4885

“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.