SCHEMBL6911358

SCHEMBL6911358

O=C1CCC2=C1C(c1ccc(F)c(C(F)(F)F)c1)C1=C(CCCS1)N2

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 20/20 0.59
ABCC8 Q09428 20/20 0.59
KCNJ11 Q14654 20/20 0.59
KCNJ8 Q15842 20/20 0.59

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
SCHEMBL6907903 0.96 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6911393 0.94 ABCC9 (0.56) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6432052 0.92 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6907973 0.88 ABCC9 (0.55) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6904323 0.85 ABCC9 (0.68) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6903934 0.85 ABCC9 (0.58) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6911846 0.84 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6910304 0.82 ABCC9 (0.67) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6903878 0.81 ABCC9 (0.56) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6905789 0.81 ABCC9 (0.72) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1040097-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2004-04-14 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-1040097-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2004-04-14 EP disclosed