SCHEMBL6276071

SCHEMBL6276071

CC1(C)Oc2ccc(C(N)=O)cc2[C@H](NCCc2ccc(F)cc2)C1O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 8/20 0.48
ABCC9 O60706 1/20 0.41
ABCB1 P08183 2/20 0.41

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
SCHEMBL5868249 1.00 KCNA5 (0.48) KCNA5ABCC9ABCB1
SCHEMBL5868254 1.00 KCNA5 (0.48) KCNA5ABCC9ABCB1
SCHEMBL5868217 0.90 KCNA5 (0.57) KCNA5ABCB1
SCHEMBL5868219 0.90 KCNA5 (0.57) KCNA5ABCB1
SCHEMBL6273955 0.90 KCNA5 (0.57) KCNA5ABCB1
SCHEMBL2878003 0.82 ABCB1 (0.40) KCNA5ABCC9ABCB1
SCHEMBL2878005 0.82 ABCB1 (0.40) KCNA5ABCC9ABCB1
SCHEMBL27408232 0.82 ABCC9 (0.61) ABCC9
SCHEMBL6281202 0.80 ABCB1 (0.64) ABCC9ABCB1
SCHEMBL5868271 0.80 ABCB1 (0.64) ABCC9ABCB1

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-1401823-B1 SUBSTITUTED BENZOPYRAN DERIVATIVES AGAINST ARRHYTHMIA NISSAN CHEMICAL IND LTD (JP) 2005-10-05 EP disclosed
EP-1401823-A1 SUBSTITUTED BENZOPYRAN DERIVATIVES AGAINST ARRHYTHMIA Nissan Chemical Industries, Ltd. (JP) 2004-03-31 EP disclosed
WO-2003000675-A1 SUBSTITUTED BENZOPYRAN DERIVATIVES AGAINST ARRHYTHMIA NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-03 WO disclosed