SCHEMBL1926554

SCHEMBL1926554

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nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35

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
SCHEMBL1926552 1.00 MAPK1 (0.35) MAPK1
SCHEMBL1926556 1.00 MAPK1 (0.35) MAPK1
SCHEMBL3439787 0.78 ALDH1A1 (0.38) MAPK1
SCHEMBL11547511 0.77 MAPK1 (0.38) MAPK1
SCHEMBL7762970 0.77 MAPK1 (0.38) MAPK1
SCHEMBL28323339 0.77 MAPK1 (0.38) MAPK1
SCHEMBL9635126 0.74 MAPK1 (0.36) MAPK1
SCHEMBL20017114 0.72 MAPK1 (0.35) MAPK1
SCHEMBL12155247 0.72 MAPK1 (0.35) MAPK1
SCHEMBL5074952 0.72 MAPK1 (0.35) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7956201-B2 Reacting glycidyl ether with fluoride salt, then dialkylmalonate, coupling of (S)-4-fluoromethyl-dihydro-furan-2-one formed with amino-pyrido[2,1-a]isoquinoline derivative, cyclization; useful for treatment and/or prophylaxis of diseases associated with DPP IV such as diabetes, inflammatory bowel disease HOFFMAN-LA ROCHE INC. (US) 2011-06-07 US disclosed
EP-2079721-B1 PROCESS FOR THE PREPARATION OF (S)-4-FLUOROMETHYL-DIHYDRO-FURAN-2-ONE HOFFMANN LA ROCHE (CH) 2010-07-28 EP disclosed
US-20080108816-A1 PROCESS FOR THE PREPARATION OF (S)-4-FLUOROMETHYL-DIHYDRO-FURAN-2-ONE F. HOFFMANN-LA ROCHE AG (CH) 2008-05-08 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-20080108816-A1 PROCESS FOR THE PREPARATION OF (S)-4-FLUOROMETHYL-DIHYDRO-FURAN-2-ONE DPP4, DPP7, DPP3 MAPK1 2236/4885

“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.