SCHEMBL8554370

SCHEMBL8554370

C=CCC=C(C)C(=O)OC(=O)C(C)=CCCCC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.33
EP300 Q09472 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
PLA2G2C Q5R387 1/20 0.31
GRIK1 P39086 1/20 0.31
PTGS2 P35354 1/20 0.31
FAAH O00519 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
SCHEMBL7754867 0.88 EP300 (0.41) TSHRALDH1A1EP300CYP2D6CYP2C19
SCHEMBL16618080 0.86 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL5459895 0.84 EP300 (0.47) EP300CYP2C19FAAH
SCHEMBL9640027 0.83 CYP2D6 (0.31) CYP2D6CYP2C19
SCHEMBL6425465 0.83 TSHR (0.44) TSHRALDH1A1HPGDEP300CYP2D6
SCHEMBL17453333 0.83 TSHR (0.34) TSHRHPGDFAAH
SCHEMBL5461045 0.82 EP300 (0.37) TSHRALDH1A1EP300CYP2D6CYP2C19
SCHEMBL15251310 0.82 EP300 (0.50) TSHREP300CYP2C19FAAH
SCHEMBL8849384 0.82 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL1001904 0.82 EP300 (0.37) TSHRALDH1A1EP300CYP2D6CYP2C19

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
EP-0723975-B1 Chemical composition, redispersible in aqueous media, containing a copolymer and a protective colloid, its aqueous polymer dispersion, methods for their production and the use thereof ELOTEX AG (CH) 1999-05-12 EP claimed