SCHEMBL698911

SCHEMBL698911

CCC1(C(=O)O)CCC(Oc2ccc(N=C3NC(=O)C(=Cc4cnc(NC(=O)C5CC5)s4)S3)c(C)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 4/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 4/20 0.34
ABL1 P00519 3/20 0.34
HPGD P15428 2/20 0.34
PTPN7 P35236 2/20 0.33
DUSP3 P51452 2/20 0.33
PTPN12 Q05209 2/20 0.33
PTPN22 Q9Y2R2 2/20 0.33
PTPN5 P54829 1/20 0.33
PTPN11 Q06124 1/20 0.33
GPR119 Q8TDV5 3/20 0.33
PLA2G1B P04054 1/20 0.33
APEX1 P27695 1/20 0.33
ATG4B Q9Y4P1 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
SCHEMBL653891 0.90 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL653892 0.90 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176524 0.89 MAPT (0.40) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176480 0.87 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176507 0.85 MAPT (0.40) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176532 0.85 PTPN7 (0.44) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176547 0.85 MAPT (0.47) MAPTLMNANPSR1RECQLTDP1
SCHEMBL650770 0.83 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL699657 0.83 MAPT (0.41) MAPTLMNANPSR1RECQLTDP1
SCHEMBL10176528 0.83 MAPT (0.42) MAPTLMNANPSR1RECQLTDP1

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-2423204-A1 THIAZOLIDINONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2012-02-29 EP disclosed