SCHEMBL4422247

SCHEMBL4422247

CC(C)(COCCC(=O)NN)COCCC(=O)NN

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.45
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.40
KDM5C P41229 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL4410181 0.83 GAA (0.44) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL4409617 0.80 GAA (0.57) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL4414727 0.78 GAA (0.55) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL4409987 0.78 GAA (0.55) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL11080634 0.77
SCHEMBL24533303 0.75 CTSD (0.60) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL437917 0.75 TSHR (0.50) GAAKDM4EALDH1A1HTTMAPT
SCHEMBL29302412 0.74 GAA (0.41) CTSDGAAKDM4EKDM5CPHF8
SCHEMBL439265 0.74 ALDH1A1 (0.37) KDM4EKDM5CPHF8KDM2ACYP2C19
SCHEMBL4412014 0.74 GAA (0.68) CTSDGAAKDM4EKDM5CPHF8

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