SCHEMBL13537372

SCHEMBL13537372

CN1CCC(n2c(Cl)c(Cl)c3ccc(NO)cc32)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
HTR1F P30939 4/20 0.34
HTR1A P08908 2/20 0.34
HTR1B P28222 2/20 0.34
HTR1D P28221 1/20 0.34
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
JAK1 P23458 3/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
DRD2 P14416 1/20 0.32
SLC6A4 P31645 1/20 0.32
APP P05067 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
GAA P10253 1/20 0.31
EGFR P00533 1/20 0.31
PIK3CA P42336 1/20 0.31
PRKDC P78527 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL13537218 0.72 HTR1A (0.39) POLBHTR1FHTR1AHTR1BHTR1D
SCHEMBL13537571 0.69 HTR1A (0.63) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL13537477 0.69 HTR1B (0.39) POLBHTR1FHTR1AHTR1BHTR1D
SCHEMBL13537308 0.68 OPRM1 (0.47) HTR1FHTR1AHTR1BHTR1DPIM1
SCHEMBL13537478 0.68 OPRM1 (0.47) HTR1FHTR1AHTR1BHTR1D
SCHEMBL13537396 0.67 HTR1A (0.51) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL13537597 0.66 HTR1A (0.52) HTR1FHTR1AHTR1BHTR1DDRD2
SCHEMBL13537498 0.65 HTR1F (0.50) HTR1FHTR1AHTR1BHTR1D
SCHEMBL13537238 0.65 HTR1F (0.62) HTR1FHTR1AHTR1BHTR1D
SCHEMBL15837036 0.64 OPRM1 (0.40) POLBSMN1; SMN2GAA

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