SCHEMBL8020739

SCHEMBL8020739

C=CCCc1cc(C)ccc1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
MAPK1 P28482 1/20 0.34
PSMB5 P28074 1/20 0.33
AMY1A P0DUB6 1/20 0.33
POLB P06746 3/20 0.33
RECQL P46063 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
MEP1B Q16820 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
CASP6 P55212 1/20 0.33
KMT2A Q03164 1/20 0.33
ELAVL1 Q15717 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RAPGEF4 Q8WZA2 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
SCHEMBL6819883 0.90 MEP1B (0.33) GAAHSD17B10L3MBTL1MAPK1PSMB5
SCHEMBL4586935 0.88 ALDH1A1 (0.34) GAAHSD17B10L3MBTL1MAPK1PSMB5
SCHEMBL9878598 0.88 ALDH1A1 (0.34) GAAHSD17B10L3MBTL1MAPK1PSMB5
SCHEMBL30823619 0.85 GAA (0.41) GAAHSD17B10L3MBTL1AMY1APOLB
SCHEMBL1180196 0.85 GAA (0.41) GAAHSD17B10L3MBTL1AMY1APOLB
SCHEMBL30059752 0.84 PTGES2 (0.37) AMY1APOLBALDH1A1MAPTKDM4E
SCHEMBL2812505 0.84 POLB (0.41) GAAL3MBTL1MAPK1PSMB5POLB
SCHEMBL8462913 0.82 GAA (0.33) GAAHSD17B10L3MBTL1AMY1APOLB
SCHEMBL5718625 0.82 GAA (0.39) GAAHSD17B10L3MBTL1AMY1APOLB
SCHEMBL29975298 0.82 GAA (0.39) GAAHSD17B10L3MBTL1AMY1APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586167-B1 Catalyst compositions and process for preparing Polyolefins BP CHEM INT LTD (GB) 2000-07-12 EP disclosed
EP-0586168-B1 Catalyst compositions and process for preparing polyolefins BP CHEM INT LTD (GB) 2000-07-05 EP disclosed
EP-0969020-A2 Mettallocene complexes BP Chemicals Limited (GB) 2000-01-05 EP disclosed
US-5747405-A COORDINATION POLMERIZATION CATALYSTS OF GROUP IV, V AND VI BP CHEMICALS LIMITED (GB) 1998-05-05 US disclosed
US-5714555-A CYCLOPENTADIENYL OR INDENYL GROUP CONTAINING GROUP 4 METALLOCENE CATALYST BP CHEMICALS LIMITED (GB) 1998-02-03 US disclosed
US-5714425-A METALLOCENE CATALYST HAVING POLYMERIZABLE OLEFINIC GROUPS; BINDER-FREE, NONDESORPTION FROM SUPPORT BP CHEMICALS LIMITED (GB) 1998-02-03 US disclosed
EP-0641809-A1 Ethylene copolymers BP Chemicals Limited (GB) 1995-03-08 EP disclosed
EP-0586167-A1 Catalyst compositions and process for preparing Polyolefins BP Chemicals Limited (GB) 1994-03-09 EP disclosed
EP-0586168-A1 Catalyst compositions and process for preparing polyolefins BP Chemicals Limited (GB) 1994-03-09 EP disclosed