SCHEMBL5512438

SCHEMBL5512438

CCCCCC(C(=O)O)n1ccnc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 10/20 0.44
TBXA2R P21731 1/20 0.44
CYP17A1 P05093 2/20 0.44
CYP26A1 O43174 1/20 0.41
CYP24A1 Q07973 1/20 0.40
GPR84 Q9NQS5 3/20 0.40
FFAR1 O14842 1/20 0.40
AGTR1 P30556 1/20 0.39
AGTR2 P50052 1/20 0.39

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
SCHEMBL5538884 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5535737 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL3137862 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5538451 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5531518 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5533163 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL729227 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5529653 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5537297 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84
SCHEMBL5531361 0.98 TBXAS1 (0.47) TBXAS1TBXA2RCYP17A1CYP26A1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109433270-B Catalyst for preparing isooctanoic acid by oxidizing isooctaldehyde, preparation method thereof and method for preparing isooctanoic acid 万华化学集团股份有限公司 2021-05-14 CN claimed
CN-109433270-A A kind of different octanal oxidation prepares catalyst of isooctyl acid and preparation method thereof, and the method for preparing isooctyl acid 万华化学集团股份有限公司 2019-03-08 CN claimed
CN-109433270-B Catalyst for preparing isooctanoic acid by oxidizing isooctaldehyde, preparation method thereof and method for preparing isooctanoic acid 万华化学集团股份有限公司 2021-05-14 CN disclosed
CN-109433270-A A kind of different octanal oxidation prepares catalyst of isooctyl acid and preparation method thereof, and the method for preparing isooctyl acid 万华化学集团股份有限公司 2019-03-08 CN disclosed
EP-1470258-B1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2013-08-28 EP disclosed
US-7250456-B2 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2007-07-31 US disclosed
US-20070044831-A1 Electrolyte composition and dye-sensitized solar cell NATIONAL UNIVERSITY CORPORATION KYUSHU INSTITUTE OF TECHNOLOGY (JP) 2007-03-01 US disclosed
US-20050148702-A1 Composition and its use for imparting water repellency to leather or furskins, textiles and other fibrous materials TFL LEDERTECHNIK GMBH (DE) 2005-07-07 US disclosed
EP-1470258-A1 COMPOSITION AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL Ledertechnik GmbH (DE) 2004-10-27 EP disclosed
WO-2003064707-A1 COMPOSITIONS AND ITS USE FOR IMPARTING WATER REPELLENCY TO LEATHER OR FURSKINS, TEXTILES AND OTHER FIBROUS MATERIALS TFL LEDERTECHNIK GMBH (DE) 2003-08-07 WO disclosed