SCHEMBL18405698

SCHEMBL18405698

CCOC(=O)/C=C/C(=O)OCC(NS(=O)(=O)C(C)(C)C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.50
▸ LMNA P02545 4/20 0.50
▸ MDM2 Q00987 2/20 0.50
▸ MDM4 O15151 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.41
▸ THRB P10828 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MMP8 P22894 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.38
▸ ATM Q13315 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ PTGS2 P35354 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
SCHEMBL18406908 0.95 MAPT (0.42) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18406898 0.95 MAPT (0.42) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405711 0.92 MAPT (0.40) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405691 0.88 HCAR2 (0.41) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405699 0.87 MAPT (0.49) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405684 0.86 MAPT (0.53) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405714 0.86 MAPT (0.53) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405701 0.84 MAPT (0.51) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18405702 0.84 MAPT (0.51) MAPTLMNAMDM2MDM4ALDH1A1
SCHEMBL18406902 0.83 MAPT (0.43) MAPTLMNAMDM2MDM4ALDH1A1

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-20170020837-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-01-26 — — US disclosed
US-20170020837-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-01-26 — — 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-20170020837-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE FH, FPGS, APC MAPT 8/4885LMNA 4358/4885MDM2 363/4885

“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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