SCHEMBL7489361

SCHEMBL7489361

CCCC[Sn](CCCC)(CCCC)c1cnn(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 8/20 0.39
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
PSIP1 O75475 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PARL Q9H300 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
ABCB1 P08183 1/20 0.32

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
SCHEMBL1384870 0.88 GRM4 (0.43) GRM4PKMMEN1KMT2ASMN1; SMN2
SCHEMBL692875 0.77
SCHEMBL7244739 0.73 GAA (0.44) GRM4GAAMEN1KMT2ASMN1; SMN2
SCHEMBL13469349 0.73 GRM4 (0.50) GRM4PKMPSIP1SMN1; SMN2PARL
SCHEMBL561256 0.70
SCHEMBL21877265 0.70 MELK (0.40) GAAPSIP1
SCHEMBL2356296 0.69 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1
SCHEMBL15614518 0.68 TSHR (0.41) GRM4KMT2ASMN1; SMN2PARLPIK3CD
SCHEMBL7490632 0.68 KMT2A (0.44) TDP1PKMMEN1KMT2ASMN1; SMN2
SCHEMBL7491164 0.67 PARL (0.42) GRM4TDP1MEN1KMT2ASMN1; SMN2

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
EP-0783499-B1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LTD (GB) 2002-10-23 EP disclosed
US-5935972-A Benzofuran derivatives as tachykinin antagonists GLAXO GROUP LIMITED (GB) 1999-08-10 US disclosed
EP-0783499-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1997-07-16 EP disclosed
WO-1995006645-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1995-03-09 WO disclosed