SCHEMBL3351946

SCHEMBL3351946

COCCn1cc(Cl)c2ccc(N)cc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.38
NFATC1 O95644 1/20 0.37
GSK3B P49841 1/20 0.37
REN P00797 4/20 0.36
ASH1L Q9NR48 2/20 0.36
CNR1 P21554 3/20 0.35
CNR2 P34972 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
P2RX7 Q99572 3/20 0.34
IL1B P01584 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC22A12 Q96S37 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
SCHEMBL31735441 0.88 DYRK1A (0.43) DYRK1ANFATC1GSK3BCNR1CNR2
SCHEMBL13537209 0.79 CNR2 (0.41) DYRK1ANFATC1GSK3BRENCNR1
SCHEMBL3349651 0.78 HTR6 (0.41) DYRK1ANFATC1GSK3BRENASH1L
SCHEMBL3352886 0.77 MAPT (0.42) ASH1LCNR2KMT2A
SCHEMBL3358037 0.75 ALDH1A1 (0.40) CNR1CNR2
SCHEMBL3351825 0.75 ACHE (0.44) NPSR1
SCHEMBL3352252 0.74 CACNB4 (0.43) NPSR1
SCHEMBL3354038 0.74 NR1H2 (0.46)
SCHEMBL27527082 0.74 CYP3A4 (0.41)
SCHEMBL13131407 0.73 REN (0.42) RENCNR1CNR2SLC22A12

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-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed