SCHEMBL6432213

SCHEMBL6432213

CC1(C)CCC2=C(C1=O)C(c1ccc(F)c(Br)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
SCHEMBL7235036 0.91 ABCC9 (0.83) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7232279 0.91 ABCC9 (0.83) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7234610 0.88 ABCC9 (0.79) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7235496 0.86 ABCC9 (0.76) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7241954 0.86 ABCC9 (0.75) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7243266 0.85 ABCC9 (0.75) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7231969 0.85 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7233146 0.85 ABCC9 (0.74) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7234820 0.85 ABCC9 (0.73) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7141004 0.84 ABCC9 (0.76) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194429-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2005-03-30 EP disclosed