SCHEMBL6885375

SCHEMBL6885375

COC(=O)C(CCC(C)=O)(C(C)=O)C(C)=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.36
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
LMNA P02545 2/20 0.32
SLC15A2 Q16348 1/20 0.32
DGAT1 O75907 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
SCHEMBL2855901 0.77 MGAM (0.39) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL5911694 0.76 ALDH1A1 (0.39) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL9854531 0.74 MEN1 (0.47) LMNA
SCHEMBL1406316 0.73 TSHR (0.55) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL28256465 0.73 TSHR (0.55) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL27823172 0.71 MGAM (0.42) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL27930574 0.71 HMGCR (0.37) ALDH1A1GAAMGAMSIMGAM2
Ethylene SCHEMBL11856135 0.71 MEN1 (0.45) TSHRLMNA
SCHEMBL10796802 0.71 ALDH1A1 (0.37) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL13284222 0.69 ALDH1A1 (0.36) ALDH1A1GAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490412-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-12-29 EP disclosed
WO-2003082929-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-10-09 WO disclosed