SCHEMBL4016548

SCHEMBL4016548

CCCCN(CCCC)CCCC.O=S(=O)(O)C=Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 8/20 0.50
ACHE P22303 6/20 0.49
TDP1 Q9NUW8 1/20 0.44
EGFR P00533 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 1/20 0.40
DRD2 P14416 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 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
SCHEMBL21990555 0.94 BCHE (0.49) BCHEACHEEGFRDRD2OPRM1
SCHEMBL21990529 0.94 BCHE (0.49) BCHEACHEEGFRDRD2OPRM1
SCHEMBL7949065 0.84 EGFR (0.47) BCHEACHETDP1EGFR
SCHEMBL7945375 0.84 NPC1 (0.47) BCHEACHEGAA
SCHEMBL28285936 0.83 EGFR (0.48) TDP1EGFRGAA
Alcohol SCHEMBL29033352 0.82 HTT (0.46) TDP1KMT2AGAA
SCHEMBL9719498 0.82 EGFR (0.43) TDP1EGFRGAA
Tetrabuthylammonium SCHEMBL5893078 0.82 EGFR (0.47) TDP1EGFRGAA
Hydroxyl Radical SCHEMBL28092208 0.82 PPARG (0.52) TDP1KMT2AGAA
Trimethylammonium SCHEMBL8097278 0.80 HTT (0.47) TDP1KMT2AGAA

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
EP-1627104-A4 ORGANIC POLYMER MATERIALS HAVING SULFONIC ACID GROUPS AND METHOD FOR THEIR PREPARATION EBARA CORP (JP) 2009-07-01 EP disclosed
CN-100390350-C Organic polymeric materials containing sulfonic acid groups and methods for their preparation EBARA CORP (JP) 2008-05-28 CN disclosed
US-20070093568-A1 Organic polymer materials having sulfonic acid groups and method for their preparation EBARA CORPORATION (JP) 2007-04-26 US disclosed
CN-1809663-A Organic polymer materials having sulfonic acid groups and method for their preparation EBARA CORP (JP) 2006-07-26 CN disclosed
EP-1627104-A1 ORGANIC POLYMER MATERIALS HAVING SULFONIC ACID GROUPS AND METHOD FOR THEIR PREPARATION Ebara Corporation (JP) 2006-02-22 EP disclosed
WO-2004106622-A1 ORGANIC POLYMER MATERIALS HAVING SULFONIC ACID GROUPS AND METHOD FOR THEIR PREPARATION EBARA CORPORATION (JP) 2004-12-09 WO disclosed
US-5728501-A POLYMERS OF ETHYLENICALLY UNSATURATED MONMERS SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-17 US disclosed