SCHEMBL5513660

SCHEMBL5513660

CCCC(C(=O)O)n1ccnc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 4/20 0.46
CYP24A1 Q07973 1/20 0.43
TBXAS1 P24557 6/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TBXA2R P21731 2/20 0.39
CYP26A1 O43174 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
SCHEMBL5531539 0.90 CYP17A1 (0.48) CYP17A1CYP24A1TBXAS1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL10770811 0.89 CYP17A1 (0.47) CYP17A1CYP24A1TBXAS1KDM4ETBXA2R
SCHEMBL5512438 0.89 TBXAS1 (0.44) CYP17A1CYP24A1TBXAS1TBXA2RCYP26A1
SCHEMBL5538451 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL3137862 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL5538884 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL5537297 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL5533163 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL5531518 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1
SCHEMBL729227 0.87 TBXAS1 (0.47) CYP17A1TBXAS1MAPTTBXA2RCYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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