SCHEMBL2855901

SCHEMBL2855901

COC(=O)C(CC(C)=O)(C(C)=O)C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALDH1A1 P00352 1/20 0.35
DGAT1 O75907 1/20 0.33
TSHR P16473 1/20 0.31
KCNN4 O15554 1/20 0.30
KDM4E B2RXH2 1/20 0.30
KDM6B O15054 1/20 0.30
KDM5C P41229 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
PHF8 Q9UPP1 1/20 0.30
KDM2A Q9Y2K7 1/20 0.30

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
SCHEMBL4649993 0.79 ALDH1A1 (0.39) MGAMGAASIMGAM2ALDH1A1
SCHEMBL6885375 0.77 ALDH1A1 (0.38) MGAMGAASIMGAM2ALDH1A1
SCHEMBL6272633 0.76 ALDH1A1 (0.37) ALDH1A1KDM4EKDM6BKDM5CEGLN1
SCHEMBL11743715 0.76 ALDH1A1 (0.37) ALDH1A1KDM4EKDM6BKDM5CEGLN1
SCHEMBL9736050 0.73 GAA (0.40) MGAMGAASIMGAM2ALDH1A1
SCHEMBL9589389 0.70 MGAM (0.37) MGAMGAASIMGAM2ALDH1A1
SCHEMBL9854531 0.69 MEN1 (0.47)
SCHEMBL31410480 0.67 GAA (0.53) MGAMGAASIMGAM2ALDH1A1
SCHEMBL14849447 0.67 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL11422045 0.66 ALDH1A1 (0.44) MGAMGAASIMGAM2ALDH1A1

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
EP-1179571-B1 CURABLE RESIN COMPOSITIONS KANEKA CORP (JP) 2010-01-13 EP disclosed
US-6569980-B1 Low modulus, elongtaion, bonding strength, waterproofing KANEKA CORPORATION (JP) 2003-05-27 US disclosed
EP-1179571-A1 CURABLE RESIN COMPOSITIONS Kaneka Corporation (JP) 2002-02-13 EP disclosed