SCHEMBL18355229

SCHEMBL18355229

CCOC(=O)NCCOC(=O)/C=C/C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
HCAR2 Q8TDS4 5/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
ATM Q13315 1/20 0.44
GLA P06280 1/20 0.42
KMT2A Q03164 1/20 0.42
ACHE P22303 8/20 0.42

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
SCHEMBL18353002 0.95 L3MBTL1 (0.49) L3MBTL1HCAR2ATMGLAKMT2A
SCHEMBL18355233 0.93 HCAR2 (0.52) L3MBTL1HCAR2ATMACHE
SCHEMBL18354873 0.90 ATM (0.50) HCAR2ATMACHE
SCHEMBL18355226 0.88 HCAR2 (0.50) L3MBTL1HCAR2ATMKMT2AACHE
SCHEMBL18354875 0.87 HCAR2 (0.50) HCAR2KEAP1NFE2L2ATMKMT2A
SCHEMBL18353205 0.84 ATM (0.55) HCAR2ATMACHE
SCHEMBL18355109 0.84 HCAR2 (0.43) L3MBTL1HCAR2ATMKMT2AACHE
SCHEMBL18353059 0.83 ATM (0.47) HCAR2KEAP1NFE2L2ATMKMT2A
SCHEMBL18354903 0.83 ATM (0.53) HCAR2ATMACHE
SCHEMBL6253988 0.81 TSHR (0.52) L3MBTL1GLAKMT2AACHE

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-20170001953-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-01-05 US disclosed
US-20170001953-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE Nguyen, Mark Quang (US) 2017-01-05 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-20170001953-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE FH, FPGS, APC L3MBTL1 4164/4885HCAR2 290/4885KEAP1 468/4885

“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.