SCHEMBL6437342

SCHEMBL6437342

O=C1CCCC2=C1C(c1ccc(F)c(F)c1)C1=C(CCS1(=O)=O)N2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 20/20 1.00
ABCC8 Q09428 20/20 1.00
KCNJ11 Q14654 20/20 1.00
KCNJ8 Q15842 20/20 1.00

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
SCHEMBL6431931 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6436507 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL4261095 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL4261651 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL4261099 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL29763179 0.90 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7249268 0.87 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7236008 0.86 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7233631 0.86 ABCC9 (0.79) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7233630 0.86 ABCC9 (0.79) ABCC9ABCC8KCNJ11KCNJ8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194429-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2005-03-30 EP claimed
US-6593335-B1 Disease than can be ameliorated with a potassium channel opener in a host mammal, comprising administering to the mammal in need thereof a therapeutically effective amount of the compound of claim 1; said disease is epilepsy, Raynaud's ABBOTT LABORATORIES 2003-07-15 US claimed
EP-1194429-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2005-03-30 EP disclosed
US-6593335-B1 Disease than can be ameliorated with a potassium channel opener in a host mammal, comprising administering to the mammal in need thereof a therapeutically effective amount of the compound of claim 1; said disease is epilepsy, Raynaud's ABBOTT LABORATORIES 2003-07-15 US disclosed
EP-1194429-A1 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-10 EP disclosed
WO-2000078768-A1 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-12-28 WO disclosed