SCHEMBL482205

SCHEMBL482205

CCN(CC)C(=O)c1ccc2c(c1)C1OC1C(C)(C)O2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.44
HPGD P15428 8/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 4/20 0.42
LMNA P02545 1/20 0.42
HSP90AA1 P07900 5/20 0.42
HSP90AB1 P08238 5/20 0.42
CYP2D6 P10635 3/20 0.41
OPRD1 P41143 3/20 0.41
KCNH2 Q12809 3/20 0.41
MAPT P10636 1/20 0.40
CYP1A2 P05177 1/20 0.39
BLM P54132 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL482483 1.00 KCNA5 (0.44) KCNA5HPGDTDP1ALDH1A1LMNA
SCHEMBL9742155 0.86 KCNA5 (0.40) KCNA5HPGDALDH1A1
SCHEMBL7048877 0.81 KDM4E (0.41)
SCHEMBL7693611 0.81 KDM4E (0.41)
SCHEMBL7048882 0.81 KDM4E (0.41)
SCHEMBL9876495 0.81 ALDH1A1 (0.41) TDP1ALDH1A1MEN1KMT2A
SCHEMBL10816515 0.80 CTNNB1 (0.37) KCNA5
SCHEMBL482263 0.78 ABCC9 (0.49) HPGDTDP1ALDH1A1MAPT
SCHEMBL482265 0.78 ABCC9 (0.49) HPGDTDP1ALDH1A1MAPT
SCHEMBL10956358 0.78 ALOX5 (0.45) HSP90AA1

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-1937669-B9 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA NV (BE) 2012-07-18 EP disclosed
EP-1937669-B1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA NV (BE) 2012-02-01 EP disclosed
EP-1940516-A2 BENZOPYRAN AND PYRANOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL OPENERS Janssen Pharmaceutica, N.V. (BE) 2008-07-09 EP disclosed
EP-1937669-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2008-07-02 EP disclosed
WO-2007027959-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-08 WO disclosed
WO-2007027780-A2 BENZOPYRAN AND PYRANOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-08 WO disclosed