SCHEMBL2548840

SCHEMBL2548840

CCCCCCCCCCCCCCCCCCC(C(=O)O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.54
NAAA Q02083 2/20 0.50
ASAH1 Q13510 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ACER2 Q5QJU3 1/20 0.50
GPR84 Q9NQS5 3/20 0.48
FFAR1 O14842 1/20 0.48
LMNA P02545 1/20 0.48
CYP2C19 P33261 1/20 0.47
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
POLB P06746 2/20 0.46
CNR2 P34972 1/20 0.46

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
SCHEMBL2554342 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL1290373 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2551104 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2552091 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2555641 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL1518057 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2550963 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2552649 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2554332 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2
SCHEMBL2550077 1.00 TBXAS1 (0.54) TBXAS1NAAAASAH1ALDH1A1ACER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN claimed
WO-2011124228-A1 A BIOCIDAL POLYOLEFIN YARN WITH 3-12 FILAMENTS VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN disclosed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO disclosed
CN-1071540-C Stabilization of aqueous 3-isothiazolone solutions ROHM & HAAS (US) 2001-09-26 CN disclosed
CN-1140542-A Stabilization of aqueous 3-isothiazolone solutions ROHM & HAAS (US) 1997-01-22 CN disclosed