SCHEMBL26971749

SCHEMBL26971749

O=C1C=CC(=O)N1CCNOC(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.42
▸ FAAH O00519 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HSP90AA1 P07900 2/20 0.37
▸ PKM P14618 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ TLR9 Q9NR96 2/20 0.37
▸ DRD2 P14416 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MC4R P32245 1/20 0.37
▸ CCR6 P51684 1/20 0.37
▸ CACNA1B Q00975 1/20 0.37
▸ APBA1 Q02410 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL28962212 0.75 ALDH1A1 (0.54) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL13650733 0.75 MGLL (0.50) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL12094240 0.75 ALDH1A1 (0.48) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL22973514 0.73 AKT1 (0.42) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL13286345 0.72 PTGS1 (0.38) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL16095877 0.71 DRD2 (0.36) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL16089528 0.71 MGLL (0.54) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL12305127 0.69 ALDH1A1 (0.55) MGLLFAAHALDH1A1LMNAHSP90AA1
Trifluoroacetic Acid SCHEMBL18261581 0.69 PTGS1 (0.49) MGLLFAAHALDH1A1LMNAHSP90AA1
SCHEMBL16195830 0.68 MGLL (0.46) MGLLFAAHALDH1A1LMNAHSP90AA1

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-11857638-B2 Quinone-containing conjugates PROMEGA CORPORATION (US) 2024-01-02 — — 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-11857638-B2 Quinone-containing conjugates NQO1, NQO2, SQOR MGLL 4683/4885FAAH 3232/4885ALDH1A1 460/4885

“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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