SCHEMBL3351511

SCHEMBL3351511

CCN1CCC(n2ncc3ccc(N)cc32)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
HTR1B P28222 1/20 0.41
HTR1F P30939 1/20 0.41
SRC P12931 2/20 0.39
SCD O00767 3/20 0.39
HTR2A P28223 5/20 0.39
HTR7 P34969 5/20 0.39
KCNH2 Q12809 3/20 0.39
DRD2 P14416 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
RAD52 P43351 2/20 0.38
GFER P55789 2/20 0.38
GPR119 Q8TDV5 1/20 0.38
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PIK3CD O00329 3/20 0.37
NR3C1 P04150 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL3354280 0.90 DRD2 (0.42) HTR1AHTR1BHTR1FSCDHTR2A
SCHEMBL3352334 0.90 HTR2A (0.45) SRCSCDHTR2AHTR7KCNH2
SCHEMBL3349663 0.85 HTR1B (0.54) HTR1AHTR1BHTR1FSCDGAA
SCHEMBL3369338 0.84 PIK3CD (0.43) HTR1AHTR1BHTR1FSCDMAPT
SCHEMBL30778591 0.82 KDM4E (0.43) HTR1AHTR1BHTR1FSCDMAPT
SCHEMBL3352822 0.82 HTR1A (0.41) HTR1AHTR1BHTR1FSCDGPR119
SCHEMBL13537592 0.81 HTR1A (0.41) HTR1AHTR1BHTR1FSCDHTR2A
SCHEMBL3351612 0.80 OGFRL1 (0.40) HTR1AHTR1BHTR1FSCDMAPT
SCHEMBL3356566 0.80 HTR2A (0.48) HTR1ASCDHTR2AHTR7KCNH2
SCHEMBL3352833 0.79 MAPT (0.45) HTR1AHTR1BHTR1FHTR2AHTR7

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