SCHEMBL27607352

SCHEMBL27607352

CCCCCC(SC(C)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
ACE2 Q9BYF1 1/20 0.44
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
CA2 P00918 1/20 0.41
MAPK1 P28482 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
ALOX5 P09917 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL5612483 0.98 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL17292916 0.98 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6897326 0.94 CA2 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL4428605 0.94 CA2 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL4428606 0.94 CA2 (0.47) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6889610 0.85 CHRM1 (0.46) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6889603 0.85 CHRM1 (0.46) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7691379 0.83 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7686321 0.83 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8198245 0.83 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD

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-1646558-B Histone deacetylase inhibitors and process for producing the same KYUSHU INST TECHNOLOGY 2010-05-12 CN disclosed
CN-1646558-A Histone deacetylase inhibitors and methods of making the same YOSHIDA MINORU NISHINO NORIKAZ (JP) 2005-07-27 CN disclosed