SCHEMBL20337332

SCHEMBL20337332

COCNC(=O)COC(=O)/C(C)=C/C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 4/20 0.35
FAAH O00519 1/20 0.32
GAA P10253 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL2115863 0.84 MEN1 (0.46) MEN1KMT2AALDH1A1FAAHSMN1; SMN2
SCHEMBL242105 0.84 MEN1 (0.46) MEN1KMT2AALDH1A1FAAHSMN1; SMN2
SCHEMBL2116143 0.80 MEN1 (0.45) MEN1KMT2AALDH1A1FAAHMAPT
SCHEMBL2135252 0.80 MEN1 (0.45) MEN1KMT2AALDH1A1FAAHMAPT
SCHEMBL2135253 0.79 MEN1 (0.43) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL2114350 0.79 MEN1 (0.43) MEN1KMT2AALDH1A1GAAKDM4E
SCHEMBL2113888 0.78 FAAH (0.54) MEN1KMT2AFAAHLMNAKDM4E
SCHEMBL1965328 0.78 FAAH (0.54) MEN1KMT2AFAAHLMNAKDM4E
SCHEMBL2114335 0.78 MEN1 (0.49) MEN1KMT2AALDH1A1FAAHLMNA
SCHEMBL2114333 0.78 MEN1 (0.49) MEN1KMT2AALDH1A1FAAHLMNA

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-20180185319-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING DIMETHYL FUMARATE BIOGEN MA INC. 2018-07-05 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-20180185319-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING DIMETHYL FUMARATE FH, FAH, MGMT MEN1 414/4885KMT2A 297/4885ALDH1A1 2678/4885

“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.