SCHEMBL4410181

SCHEMBL4410181

NNC(=O)CCOCC(COCCC(=O)NN)(COCCC(=O)NN)COCCC(=O)NN

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.43
CTSD P07339 1/20 0.43
KDM5C P41229 1/20 0.43
PHF8 Q9UPP1 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2D6 P10635 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
THRB P10828 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
SCHEMBL4409617 0.84 GAA (0.57) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL4422247 0.83 CTSD (0.45) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL4409987 0.81 GAA (0.55) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL4414727 0.81 GAA (0.55) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL24116089 0.81 GAA (0.35) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL10172428 0.78 LMNA (0.41) LMNAPOLBTHRB
SCHEMBL4412014 0.77 GAA (0.68) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL4411666 0.77 GAA (0.62) GAAKDM4ECTSDKDM5CPHF8
SCHEMBL5838416 0.76 TSHR (0.35) CYP3A4CYP2C19CYP2D6
SCHEMBL11080634 0.76

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638565-B2 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-12-29 US disclosed
US-20070054998-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-03-08 US disclosed
EP-1686156-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-08-02 EP disclosed