SCHEMBL8557985

SCHEMBL8557985

COC(=O)c1ccc(COC(=S)c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
PKM P14618 1/20 0.57
KMT2A Q03164 4/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A3 Q01959 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MAPT P10636 4/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
ALDH1A1 P00352 3/20 0.55
GAA P10253 2/20 0.55
NPC1 O15118 2/20 0.55
HPGD P15428 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPK1 P28482 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MGLL Q99685 1/20 0.52
LMNA P02545 1/20 0.51
MEN1 O00255 3/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL8557978 0.87 CA1 (0.62) TSHRPKMKMT2AMAPTRAB9A
SCHEMBL6647657 0.83 PKM (0.61) TSHRPKMKMT2ASLC6A2SLC6A3
SCHEMBL28683220 0.82 KMT2A (0.50) KMT2ASLC6A2SLC6A3TDP1MAPT
SCHEMBL22388846 0.82 KMT2A (0.76) TSHRPKMKMT2ASLC6A2SLC6A3
SCHEMBL7900071 0.82 TSHR (0.58) TSHRPKMKMT2ASLC6A2SLC6A3
SCHEMBL5597240 0.80 TDP1 (0.59) TSHRKMT2ASLC6A2SLC6A3TDP1
SCHEMBL26127977 0.80 TDP1 (0.59) TSHRKMT2ASLC6A2SLC6A3TDP1
SCHEMBL4910233 0.79 TSHR (0.54) TSHRPKMKMT2ASLC6A2SLC6A3
SCHEMBL9233919 0.79 TSHR (0.62) TSHRPKMKMT2ASLC6A2SLC6A3
SCHEMBL2969506 0.79 ALDH1A1 (0.70) TSHRPKMKMT2ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586379-B1 POLYMERISATION REGULATION COMMW SCIENT IND RES ORG (AU) 1998-05-20 EP disclosed
US-5739228-A Polymerization using thionoester compounds as chain transfer agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1998-04-14 US disclosed
EP-0586379-A1 POLYMERISATION REGULATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1994-03-16 EP disclosed
EP-0586379-A4 POLYMERISATION REGULATION. COMMW SCIENT IND RES ORG (AU) 1993-12-10 EP disclosed
WO-1992013903-A1 POLYMERISATION REGULATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1992-08-20 WO disclosed