SCHEMBL9824592

SCHEMBL9824592

CCOC(=O)CC(=O)CSCCOC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
GAA P10253 2/20 0.47
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
ALDH1A1 P00352 9/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 2/20 0.40
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
HTT P42858 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.36
FAAH O00519 1/20 0.36

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
SCHEMBL9824029 0.86 ALDH1A1 (0.39) HSD17B10GAAMGAMSIMGAM2
SCHEMBL10959041 0.84 GAA (0.54) HSD17B10GAAMGAMSIMGAM2
SCHEMBL11451516 0.81 HSD17B10 (0.50) HSD17B10GAAMGAMSIMGAM2
SCHEMBL9824473 0.81 GAA (0.50) HSD17B10GAAMGAMSIMGAM2
SCHEMBL3388745 0.78 GAA (0.56) HSD17B10GAAMGAMSIMGAM2
SCHEMBL8866115 0.78 CES2 (0.55) HSD17B10GAAMGAMSIMGAM2
SCHEMBL2074701 0.77 GAA (0.54) HSD17B10GAAMGAMSIMGAM2
SCHEMBL9154310 0.77 HSD17B10 (0.47) HSD17B10GAAMGAMSIMGAM2
SCHEMBL155563 0.75 GAA (0.78) HSD17B10GAAMGAMSIMGAM2
SCHEMBL9668309 0.74 GAA (0.45) HSD17B10GAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208346-B1 DIFFUSION TRANSFER REVERSAL PROCESS AGFA-GEVAERT N.V. (BE) 1991-11-21 EP disclosed
US-4859565-A Diffusion transfer reversal process AGFA-GEVAERT, N.V. (BE) 1989-08-22 US disclosed
EP-0190375-B1 SUBSTITUTED TRIAZOLOPYRIMIDINES AND THEIR USE IN LIGHT-SENSITIVE PHOTOGRAPHIC ELEMENTS AGFA-GEVAERT N.V. (BE) 1989-04-19 EP disclosed
US-4727017-A ANTIFOGGING AGENTS; STABILIZERS AGFA-GEVAERT, N.V. (BE) 1988-02-23 US disclosed
EP-0208346-A2 Diffusion transfer reversal process AGFA-GEVAERT N.V. (BE) 1987-01-14 EP disclosed
EP-0190375-A1 Substituted triazolopyrimidines and their use in light-sensitive photographic elements AGFA-GEVAERT N.V. (BE) 1986-08-13 EP disclosed