SCHEMBL13699799

SCHEMBL13699799

Bc1cc(F)c2c(C(=O)NCC3CCCCCC3)cn(CC)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.51
P2RX7 Q99572 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
FOXO1 Q12778 1/20 0.42
HDAC6 Q9UBN7 3/20 0.41
MLYCD O95822 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
IL1B P01584 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
HDAC4 P56524 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
SCHEMBL1020668 0.88 PDE10A (0.51) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL1018854 0.88 PDE10A (0.51) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL12955100 0.88 P2RX7 (0.52) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL13673128 0.85 PDE10A (0.51) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL1020143 0.83 CNR1 (0.56) PDE10AP2RX7CNR1IL1B
SCHEMBL1019066 0.82 PDE10A (0.52) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL1019950 0.81 NPC1 (0.57) PDE10AP2RX7NPC1RAB9AIL1B
SCHEMBL13672956 0.81 PDE10A (0.51) PDE10AP2RX7NPC1MEN1KMT2A
SCHEMBL1020731 0.81 PDE10A (0.51) PDE10AP2RX7NPC1RAB9AMEN1
SCHEMBL1020250 0.79 PDE10A (0.53) PDE10AP2RX7NPC1RAB9AMEN1

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
EP-2105164-A1 Novel P2X7R antagonists and their use Affectis Pharmaceuticals AG (DE) 2009-09-30 EP disclosed