SCHEMBL2867449

SCHEMBL2867449

c1ccc(-c2ccc(Oc3ccccc3Oc3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
MAPK1 P28482 1/20 0.58
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
NCOA1 Q15788 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
SLC6A4 P31645 2/20 0.49
HTR2A P28223 1/20 0.49
LTA4H P09960 3/20 0.48
TSHR P16473 1/20 0.48
GSTP1 P09211 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
IKBKB O14920 1/20 0.44
BRAF P15056 1/20 0.44
HTR1A P08908 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
Biphenyl SCHEMBL10754506 0.90 TSHR (0.55) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL2856827 0.86 HTR2A (0.47) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL10679848 0.86 NCOA1 (0.48) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL9208935 0.86 NCOA1 (0.75) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL3893171 0.86 ALDH1A1 (0.67) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL10686173 0.86 LTA4H (0.65) ALDH1A1MAPK1LTA4HTSHRGSTP1
SCHEMBL3681820 0.86 LTA4H (0.65) ALDH1A1MAPK1LTA4HTSHRGSTP1
SCHEMBL2856821 0.86 LTA4H (0.65) ALDH1A1MAPK1LTA4HTSHRGSTP1
SCHEMBL28993129 0.84 IKBKB (0.64) ALDH1A1MAPK1HTTL3MBTL1NCOA1
SCHEMBL5567756 0.84 NCOA1 (0.47) ALDH1A1MAPK1HTTL3MBTL1NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754844-B2 Polyarylene ether compound containing sulfonic acid group, composition containing same, and method for manufacturing those TOYO BOSEKI KABUSHIKI KAISHA (JP) 2010-07-13 US disclosed
EP-1561768-B1 POLYARYLENE ETHER COMPOUND CONTAINING SULFONIC ACID GROUP, COMPOSITION CONTAINING SAME, AND METHOD FOR MANUFACTURING THOSE TOYO BOSEKI (JP) 2009-09-30 EP disclosed
US-20060166048-A1 Polyarylene ether compound containing sulfonic acid group, composition containing same, and method for manufacturing those TOYO BOSEKI KABUSHIKI KAISHA (JP) 2006-07-27 US disclosed
EP-1561768-A1 POLYARYLENE ETHER COMPOUND CONTAINING SULFONIC ACID GROUP, COMPOSITION CONTAINING SAME, AND METHOD FOR MANUFACTURING THOSE Toyo Boseki Kabushiki Kaisha (JP) 2005-08-10 EP disclosed