SCHEMBL11071869

SCHEMBL11071869

O=C1CCc2c(ccc(Cl)c2OCC(O)CN2CCC(c3ccccc3)CC2)N1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.55
SCN5A Q14524 3/20 0.55
SCN9A Q15858 3/20 0.55
KCNH2 Q12809 3/20 0.46
SLC18A3 Q16572 2/20 0.45
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
DRD4 P21917 4/20 0.40
DRD2 P14416 3/20 0.40
DRD3 P35462 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL11071393 0.87 SCN1A (0.49) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL11061316 0.84 SCN5A (0.69) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL11064138 0.80 KCNH2 (0.64) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL11065488 0.79 KCNH2 (0.43) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL10572916 0.79 KCNH2 (0.58) SCN1ASCN5ASCN9AKCNH2MEN1
SCHEMBL11073822 0.78 KCNH2 (0.54) SCN1ASCN5ASCN9AKCNH2DRD2
SCHEMBL11066783 0.76 SLC18A3 (0.38) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL11069036 0.76 SCN1A (0.52) SCN1ASCN5ASCN9AKCNH2SLC18A3
SCHEMBL10569933 0.75 KCNH2 (0.44) SCN1ASCN5ASCN9AKCNH2KMT2A
SCHEMBL10663156 0.74 KCNH2 (0.54) SCN1ASCN5ASCN9AKCNH2MEN1

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
US-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed