SCHEMBL11209321

SCHEMBL11209321

CCCCS(=O)(=O)O.CCCCS(=O)(=O)O.[Na]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.50
EPHX2 P34913 1/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 2/20 0.44
S1PR2 O95136 2/20 0.44
S1PR1 P21453 2/20 0.44
NPC1 O15118 1/20 0.44
S1PR4 O95977 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
XBP1 P17861 1/20 0.44
MAPK1 P28482 1/20 0.44
AGTR1 P30556 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL5015 0.97
SCHEMBL31512497 0.97
SCHEMBL10012319 0.97
Bromide SCHEMBL11745564 0.94
SCHEMBL1786796 0.94
Phosphine SCHEMBL2572785 0.94
SCHEMBL59926 0.94
Butane SCHEMBL21052118 0.94 APP (0.50) APPEPHX2LMNATP53S1PR2
SCHEMBL21859086 0.94
Ammonia Solution, Strong SCHEMBL6871055 0.94

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
CN-107964141-B Anti-tearing sole and preparation method thereof 温州市小林鞋材有限公司 2020-09-08 CN claimed
CN-107964141-B Anti-tearing sole and preparation method thereof 温州市小林鞋材有限公司 2020-09-08 CN disclosed
US-4351666-A PRETREATMENT BEFORE HARVESTING UNION CARBIDE CORPORATION (US) 1982-09-28 US disclosed
US-4334913-A APPLYING TO SUGAR CANE, SORGHUM UNION CARBIDE CORPORATION (US) 1982-06-15 US disclosed
US-4280832-A Pyridyloxy-phenoxyalkane carboxylic acids and derivatives as sugar enhancers for plants UNION CARBIDE CORPORATION (US) 1981-07-28 US disclosed
US-4276080-A Phenoxy-phenoxyalkane carboxylic acids and derivatives as sugar enhancers for plants UNION CARBIDE CORPORATION (US) 1981-06-30 US disclosed