SCHEMBL13664745

SCHEMBL13664745

Cc1c(Cl)cccc1N1CC2(CC2)CNCC1=O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.55
SLC6A4 P31645 3/20 0.55
SLC6A3 Q01959 3/20 0.55
RECQL P46063 1/20 0.52
HCAR1 Q9BXC0 2/20 0.39
P2RX7 Q99572 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 2/20 0.35
ALOX15 P16050 1/20 0.35
NOTUM Q6P988 2/20 0.34
ADAMTS5 Q9UNA0 1/20 0.33
MGLL Q99685 1/20 0.33

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
SCHEMBL2985382 0.79 RECQL (0.54) SLC6A2SLC6A4SLC6A3RECQLHCAR1
SCHEMBL13664823 0.75 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3RECQLHCAR1
Acetic Acid SCHEMBL2981956 0.74 RECQL (0.48) RECQLHCAR1P2RX7MEN1KMT2A
SCHEMBL292679 0.67 HSD11B1 (0.46) RECQLMGLL
SCHEMBL13664738 0.67 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL13664713 0.66 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3RECQLMEN1
SCHEMBL293635 0.65 RECQL (0.40) RECQLHCAR1P2RX7MEN1KMT2A
SCHEMBL30910322 0.63 NPC1 (0.54) RECQLP2RX7MEN1KMT2AGAA
SCHEMBL9172497 0.63 MGLL (0.66) RECQLHCAR1GAAALOX15MGLL
SCHEMBL15761176 0.61 RECQL (0.45) RECQLHCAR1P2RX7GAAALOX15

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
WO-2009119528-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed