SCHEMBL19180597

SCHEMBL19180597

CCOC(=O)c1cc2c(=O)c3cc(C4CCC(C)(C)CC4)ccc3oc2nc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 20/20 1.00
▸ IKBKE Q14164 9/20 0.63

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
SCHEMBL19181439 0.93 TBK1 (0.86) TBK1IKBKE
SCHEMBL19180347 0.92 TBK1 (0.85) TBK1IKBKE
SCHEMBL19180094 0.91 TBK1 (0.83) TBK1IKBKE
SCHEMBL19182151 0.91 TBK1 (0.83) TBK1IKBKE
SCHEMBL19180584 0.91 TBK1 (0.83) TBK1IKBKE
SCHEMBL19180478 0.90 TBK1 (0.82) TBK1IKBKE
SCHEMBL19180143 0.90 TBK1 (0.82) TBK1IKBKE
SCHEMBL19182269 0.89 TBK1 (0.81) TBK1IKBKE
SCHEMBL19182129 0.89 TBK1 (0.81) TBK1IKBKE
SCHEMBL19180544 0.89 TBK1 (0.81) TBK1IKBKE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170217980-A1 AMLEXANOX ANALOGS THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2017-08-03 — — US disclosed
US-20170217980-A1 AMLEXANOX ANALOGS THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2017-08-03 — — 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-20170217980-A1 AMLEXANOX ANALOGS GPR119, GLP1R, IRS1 TBK1 494/4885IKBKE 189/4885

“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.

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