SCHEMBL6677409

SCHEMBL6677409

C=C(C)C(=O)OC.CC=C(C)C(=O)O.CCCCC=C(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 3/20 0.38
EP300 Q09472 1/20 0.37
GRIK1 P39086 1/20 0.34
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL1345248 0.95 ALDH1A1 (0.48) ALDH1A1TSHREP300GRIK1CYP2D6
SCHEMBL31036754 0.90 EP300 (0.49) ALDH1A1TSHREP300CYP2C19
SCHEMBL8943417 0.90 EP300 (0.49) ALDH1A1TSHREP300CYP2C19
SCHEMBL8764410 0.87 ALDH1A1 (0.41) ALDH1A1TSHREP300GRIK1CYP2D6
SCHEMBL523379 0.85 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL6524837 0.85 TSHR (0.36) TSHREP300GRIK1
Methacrylic Acid SCHEMBL27825741 0.84 ALDH1A1 (0.41) ALDH1A1TSHREP300GRIK1CYP2D6
SCHEMBL3634992 0.84 EP300 (0.48) TSHREP300GRIK1CYP2C19
SCHEMBL8467097 0.84 EP300 (0.48) TSHREP300GRIK1CYP2C19
SCHEMBL17749039 0.83 ALDH1A1 (0.42) ALDH1A1TSHREP300GRIK1

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
EP-1464119-A2 BIOCOMPATIBLE MEMBRANES OF BLOCK COPOLYMERS AND FUEL CELLS PRODUCED THEREWITH Powerzyme, Inc. (US) 2004-10-06 EP disclosed
WO-2003050897-A2 BIOCOMPATIBLE MEMBRANES OF BLOCK COPOLYMERS AND FUEL CELLS PRODUCED THEREWITH POWERZYME, INC. (US) 2003-06-19 WO disclosed