SCHEMBL8399384

SCHEMBL8399384

COC(=O)CCC(S)CC(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
SLC1A1 P43005 1/20 0.42
HSD17B10 Q99714 2/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 4/20 0.38
CA12 O43570 2/20 0.38
CA14 Q9ULX7 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.33

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
SCHEMBL9869804 0.88 TSHR (0.47) TSHRSLC1A1HSD17B10KMT2AMEN1
SCHEMBL7784843 0.84 TSHR (0.50) TSHRHSD17B10KMT2AMEN1LMNA
SCHEMBL5898807 0.83 TSHR (0.41) TSHRHSD17B10KMT2AMEN1LMNA
SCHEMBL10929135 0.79
SCHEMBL11804805 0.78 ZDHHC7 (0.46) HSD17B10KMT2AMEN1LMNARECQL
SCHEMBL2865042 0.77
SCHEMBL10044830 0.77 TSHR (0.55) TSHRSLC1A1HSD17B10KMT2AMEN1
SCHEMBL5898819 0.77
SCHEMBL28608801 0.76 ZDHHC7 (0.49) HSD17B10KMT2AMEN1LMNACA12
SCHEMBL11806080 0.76 ZDHHC7 (0.49) HSD17B10KMT2AMEN1LMNACA12

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-9074110-B2 Method for producing release liners TESA SE (DE) 2015-07-07 US disclosed
US-20110186219-A1 Method for producing release liners TESA SE (DE) 2011-08-04 US disclosed
US-5919971-A REACTING HYDROGEN SULFIDE WITH THE CORRESPONDING ACRYLIC ACID ESTER IN PRESENCE OF A SOLID SUPPORT ELF ACQUITAINE EXPLORATION PRODUCTION FRANCE (FR) 1999-07-06 US disclosed
CN-1185431-A Process for synthesis of 3-mercaptoprapionic acid esters ELF AQUITAINE EXPLORATION PROD (FR) 1998-06-24 CN disclosed