SCHEMBL3829564

SCHEMBL3829564

Cc1ccc(C(=O)N(Cc2csc(N3CCOCC3)n2)c2ccc(F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
DNM1L O00429 1/20 0.46
AR P10275 4/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 3/20 0.43
HTT P42858 1/20 0.43
TACR3 P29371 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
BCHE P06276 1/20 0.41
GRIA2 P42262 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
APEX1 P27695 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
SCHEMBL3826390 0.91 MAPT (0.50) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL3821644 0.90 LMNA (0.49) ALDH1A1HSD17B10DNM1LARNPC1
SCHEMBL3064271 0.86 AR (0.50) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL4738762 0.86 AR (0.44) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL4734899 0.85 AR (0.42) ALDH1A1ARNPC1RAB9ALMNA
SCHEMBL4739647 0.85 AR (0.43) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL4735442 0.84 AR (0.43) ALDH1A1ARNPC1RAB9ALMNA
SCHEMBL3059056 0.83 AR (0.47) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL3047804 0.83 AR (0.47) ALDH1A1DNM1LARNPC1RAB9A
SCHEMBL3071134 0.82 AR (0.47) ALDH1A1ARNPC1RAB9ALMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097379-A1 CARBOXAMIDE DERIVATIVES AS ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2009-09-09 EP claimed
WO-2008073936-A1 CARBOXAMIDE DERIVATIVES AS ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed