SCHEMBL18355233

SCHEMBL18355233

CCOC(=O)/C=C/C(=O)OCCNC(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.52
L3MBTL1 Q9Y468 1/20 0.48
ATM Q13315 1/20 0.47
ACHE P22303 8/20 0.44
MAPT P10636 1/20 0.41

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 0.98 L3MBTL1 (0.49) HCAR2L3MBTL1ATMACHE
SCHEMBL18355229 0.93 L3MBTL1 (0.46) HCAR2L3MBTL1ATMACHE
SCHEMBL18355226 0.91 HCAR2 (0.50) HCAR2L3MBTL1ATMACHEMAPT
SCHEMBL18354903 0.89 ATM (0.53) HCAR2ATMACHE
SCHEMBL18353205 0.87 ATM (0.55) HCAR2ATMACHEMAPT
SCHEMBL18355109 0.87 HCAR2 (0.43) HCAR2L3MBTL1ATMACHEMAPT
SCHEMBL18364167 0.85 HCAR2 (0.52) HCAR2ATMMAPT
SCHEMBL18354850 0.85 SMN1; SMN2 (0.45) HCAR2L3MBTL1ATMMAPT
SCHEMBL18355322 0.85 TDP1 (0.45) HCAR2L3MBTL1ATMMAPT
SCHEMBL18374996 0.84 MAPT (0.50) HCAR2L3MBTL1ATMMAPT

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 HCAR2 290/4885L3MBTL1 4164/4885ATM 4406/4885

“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.