SCHEMBL27679136

SCHEMBL27679136

O=C(O)CCCCC(CCC(=O)O)S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
NFKB1 P19838 2/20 0.44
TSHR P16473 1/20 0.44
PMP22 Q01453 1/20 0.44
GSTK1 Q9Y2Q3 2/20 0.44
FFAR1 O14842 2/20 0.43
FFAR4 Q5NUL3 2/20 0.43
GPR84 Q9NQS5 1/20 0.43
ENPEP Q07075 1/20 0.42
CAMK2A Q9UQM7 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.40
ALDH1A1 P00352 1/20 0.40
AKR1B1 P15121 1/20 0.38
CYP2D6 P10635 1/20 0.38
FOLH1 Q04609 1/20 0.38

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
SCHEMBL12226844 0.89 TET2 (0.44) LMNANFKB1ENPEPCYP2D6FOLH1
SCHEMBL8831544 0.85 ALDH1A1 (0.56) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL8831205 0.85 FFAR4 (0.62) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL8831318 0.85 FFAR4 (0.62) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL16342953 0.85 FFAR4 (0.62) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL18677287 0.85 FFAR4 (0.62) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL8831180 0.85 FFAR4 (0.62) TSHRFFAR1FFAR4GPR84SLC22A6
SCHEMBL28245758 0.82 LMNA (0.41) LMNANFKB1TSHRPMP22GSTK1
SCHEMBL28245698 0.82 LMNA (0.41) LMNANFKB1TSHRPMP22GSTK1
SCHEMBL16719255 0.82 FFAR4 (0.50) LMNANFKB1TSHRPMP22FFAR1

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
CN-102073233-A Coloring material and method for producing coloring material TOSHIBA TEC KK 2011-05-25 CN disclosed
CN-1940739-A Erasable image forming material TOKYO SHIBAURA ELECTRIC CO (JP) 2007-04-04 CN disclosed