SCHEMBL4196941

SCHEMBL4196941

NC(=O)N(S)c1cc(F)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.34
GRM2 Q14416 1/20 0.33
HPGD P15428 1/20 0.33
KEAP1 Q14145 1/20 0.33
MAPK14 Q16539 2/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
MDM2 Q00987 1/20 0.32
KCNN4 O15554 4/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL2588967 0.82 ALDH1A1 (0.41) PARP1HPGDKDM4EPOLBALDH1A1
SCHEMBL14053273 0.76 CYP1A2 (0.42) KDM4E
SCHEMBL3265387 0.74 CES2 (0.39) KDM4EPOLBCES2CES1ALDH1A1
SCHEMBL14053331 0.72 IRAK4 (0.42) HPGDPOLBALDH1A1
SCHEMBL653173 0.71 FSCN1 (0.51) PARP1HPGDKDM4EALDH1A1
Carbamic Acid SCHEMBL11787925 0.70 TSHR (0.48) PARP1GRM2HPGDKEAP1
SCHEMBL320721 0.70 KCNN4 (0.42) CES2CES1KCNN4ALDH1A1
SCHEMBL526256 0.69 TSHR (0.39) ALDH1A1
SCHEMBL1785686 0.68 ALDH1A1 (0.50) PARP1GRM2HPGDKEAP1CES2
SCHEMBL9264543 0.68 PARP1 (0.48) PARP1CES2CES1KCNN4ALDH1A1

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-2009026345-A1 THIAZOLIDINONE COMPOUNDS, AND METHODS OF MAKING AND USING SAME TARGEGEN INC. (US) 2009-02-26 WO disclosed