SCHEMBL7705767

SCHEMBL7705767

COC(=O)CC(=O)C[C]=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
TSHR P16473 4/20 0.43
HSD17B10 Q99714 3/20 0.40
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 2/20 0.33
TET2 Q6N021 1/20 0.33
MEN1 O00255 1/20 0.33
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
POLB P06746 1/20 0.31
POLA1 P09884 1/20 0.31
PKM P14618 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
SCHEMBL209791 0.81
SCHEMBL5353921 0.78 MCL1 (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL27976 0.78 MGAM (0.61) MGAMGAASIMGAM2TSHR
SCHEMBL4812141 0.76 TSHR (0.54) TSHRHSD17B10LMNAKDM4EKMT2A
SCHEMBL15688315 0.75 MGAM (0.58) MGAMGAASIMGAM2TSHR
SCHEMBL5573998 0.74
SCHEMBL11756126 0.73 TSHR (0.61) MGAMGAASIMGAM2TSHR
SCHEMBL570228 0.71
SCHEMBL53913 0.71
SCHEMBL3441102 0.71 MGAM (0.69) MGAMGAASIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355713-B1 THERMOPLASTIC RESINS ARE STABILIZED WITH B-ENAMINES OR DERIVATIVES OF ALCOHOLS,SUGARS, SUGAR ALCOHOLS, GLYCOSIDES AND OLIGOSACCHARIDES; DISCOLORATION INHIBITION AKCROS, CHEMICALS (GB) 2002-03-12 US disclosed
EP-0986605-A1 BETA-KETOESTERS FOR USE AS POLYMER STABILISERS AKCROS CHEMICALS (GB) 2000-03-22 EP disclosed
WO-1998054246-A1 β-KETOESTERS FOR USE AS POLYMER STABILISERS AKCROS CHEMICALS (GB) 1998-12-03 WO disclosed
EP-0881253-A1 B-ketoesters for use as polymer stabilisers AKCROS CHEMICALS (GB) 1998-12-02 EP disclosed