SCHEMBL2228974

SCHEMBL2228974

CC(C)(C)OC(=O)[C@@H](CCCCC(=O)OCc1ccccc1)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
SYK P43405 1/20 0.39
POLB P06746 2/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
LTA4H P09960 1/20 0.38
TLR2 O60603 1/20 0.37
TLR1 Q15399 1/20 0.37
EPHX2 P34913 1/20 0.37
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KLK7 P49862 1/20 0.36
KLK5 Q9Y337 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL2228971 1.00 MAPT (0.43) MAPTSYKPOLBGAAMEN1
SCHEMBL2223899 1.00 MAPT (0.43) MAPTSYKPOLBGAAMEN1
SCHEMBL2189800 0.89 ALDH1A1 (0.41) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL22465650 0.89 ALDH1A1 (0.45) MAPTSYKPOLBGAAMEN1
SCHEMBL30018603 0.88 ALDH1A1 (0.42) MAPTSYKPOLBMEN1KMT2A
SCHEMBL30019078 0.88 ALDH1A1 (0.42) MAPTSYKPOLBMEN1KMT2A
SCHEMBL30019063 0.88 ALDH1A1 (0.42) MAPTSYKPOLBMEN1KMT2A
SCHEMBL20943331 0.88 ALDH1A1 (0.44) MAPTSYKPOLBMEN1KMT2A
SCHEMBL20943409 0.88 ALDH1A1 (0.44) MAPTSYKPOLBMEN1KMT2A
SCHEMBL20943366 0.88 ALDH1A1 (0.44) MAPTSYKPOLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2521447-B1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS INC (US) 2017-06-14 EP disclosed
US-20160340294-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2016-11-24 US disclosed
US-9289503-B2 Fatty acid fumarate derivatives and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2016-03-22 US disclosed
US-20150238618-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2015-08-27 US disclosed
US-8969354-B2 Fatty acid fumarate derivatives and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2015-03-03 US disclosed
US-20130065909-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2013-03-14 US disclosed
EP-2521447-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES Catabasis Pharmaceuticals, Inc. (US) 2012-11-14 EP disclosed
WO-2011085211-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2011-07-14 WO 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 (3 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-20130065909-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES FH, FASN, ELOVL1 MAPT 253/4885SYK 4749/4885POLB 2413/4885
US-20150238618-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES FH, FASN, ELOVL1 MAPT 253/4885SYK 4749/4885POLB 2413/4885
US-20160340294-A1 FATTY ACID FUMARATE DERIVATIVES AND THEIR USES FH, FASN, ELOVL1 MAPT 253/4885SYK 4749/4885POLB 2413/4885

“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.