SCHEMBL7358574

SCHEMBL7358574

CC(CO[Si](C)(C)C(C)(C)C)Cc1ccc(B(O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.39
LIPG Q9Y5X9 7/20 0.39
CSK P41240 1/20 0.35
CA2 P00918 3/20 0.35
CA1 P00915 2/20 0.35
F11 P03951 1/20 0.34
TRPV1 Q8NER1 2/20 0.33
MGLL Q99685 1/20 0.33
ENPP2 Q13822 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
SCHEMBL13643113 0.81 NPC1 (0.33)
SCHEMBL7361270 0.81 MME (0.35)
SCHEMBL3857190 0.79 LPL (0.33) LPLLIPGCA2CA1MGLL
SCHEMBL3863324 0.79 LPL (0.41) LPLLIPGCSKCA2CA1
SCHEMBL9030829 0.79 LPL (0.46) LPLLIPGCA2CA1F11
SCHEMBL8341445 0.76 LIPG (0.36) LIPGENPP2
SCHEMBL3653470 0.76 LPL (0.49) LPLLIPGCA2CA1F11
SCHEMBL13643112 0.76 CA1 (0.35) CA2CA1
SCHEMBL13643111 0.71 MEN1 (0.30)
SCHEMBL3308806 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832082-B1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ASTRAZENECA AB (SE) 2001-11-21 EP disclosed
US-6258817-B1 PRODRUGS, HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS ZENECA LTD. (GB) 2001-07-10 US disclosed
US-6060475-A Substituted pyrazin-2-yl-sulphonamide-(3-pyridyl) compounds and uses thereof ZENECA LIMITED (GB) 2000-05-09 US disclosed
EP-0832082-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1998-04-01 EP disclosed
WO-1996040681-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1996-12-19 WO disclosed