SCHEMBL11065488

SCHEMBL11065488

O=C1CCc2cc(Cl)c(OCC(O)CN3CCC(c4ccccc4)CC3)c(Br)c2N1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.43
SCN1A P35498 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN9A Q15858 1/20 0.43
SLC18A3 Q16572 3/20 0.43
CCR1 P32246 1/20 0.42
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 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
SCHEMBL10571685 0.86 KCNH2 (0.56) KCNH2
SCHEMBL11071393 0.86 SCN1A (0.49) KCNH2SCN1ASCN5ASCN9ASLC18A3
SCHEMBL11071869 0.79 SCN1A (0.55) KCNH2SCN1ASCN5ASCN9ASLC18A3
SCHEMBL11064138 0.77 KCNH2 (0.64) KCNH2SCN1ASCN5ASCN9ASLC18A3
SCHEMBL11073822 0.77 KCNH2 (0.54) KCNH2SCN1ASCN5ASCN9APRMT5
SCHEMBL10568098 0.76 KCNH2 (0.43) KCNH2
SCHEMBL11066783 0.76 SLC18A3 (0.38) KCNH2SCN1ASCN5ASCN9ASLC18A3
SCHEMBL11069036 0.75 SCN1A (0.52) KCNH2SCN1ASCN5ASCN9ASLC18A3
SCHEMBL11066594 0.72 MAOB (0.57)
SCHEMBL11061316 0.72 SCN5A (0.69) KCNH2SCN1ASCN5ASCN9ASLC18A3

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