SCHEMBL20356713

SCHEMBL20356713

CCOC(O)c1cnn2ccc(=O)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.42
▸ CRBN Q96SW2 1/20 0.32
▸ DUT P33316 2/20 0.32
▸ PLAT P00750 2/20 0.31
▸ IRAK4 Q9NWZ3 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
SCHEMBL404918 0.72 PLAT (0.53) PLAT
SCHEMBL20356642 0.71 PKM (0.42) PKMCRBNDUT
SCHEMBL18654699 0.69 FLT3 (0.34) —
SCHEMBL14269847 0.69 CRBN (0.38) CRBNIRAK4
SCHEMBL23230384 0.68 PKM (0.40) PKM
SCHEMBL405059 0.67 PLAT (0.50) PLATIRAK4
SCHEMBL31001803 0.66 HCAR1 (0.36) CRBNPLAT
SCHEMBL10190930 0.66 CRBN (0.34) CRBNPLATIRAK4
SCHEMBL28948286 0.66 PLAT (0.42) CRBNPLATIRAK4
SCHEMBL406392 0.65 PLAT (0.46) PLATIRAK4

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-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2018-07-05 — — 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-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 PKM 2281/4885CRBN 1773/4885DUT 333/4885

“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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