SCHEMBL8560951

SCHEMBL8560951

OCc1ccc(COC(=S)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
TSHR P16473 2/20 0.46
LTA4H P09960 1/20 0.46
ALDH1A1 P00352 6/20 0.40
LMNA P02545 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 3/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39

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
SCHEMBL26127977 0.88 TDP1 (0.59) KMT2ATDP1CA12CA1CA2
SCHEMBL5597240 0.88 TDP1 (0.59) KMT2ATDP1CA12CA1CA2
Thiobenzoic Acid SCHEMBL36460 0.83 TDP1 (0.53) KMT2ATDP1CA12CA1CA2
Thiobenzoic Acid SCHEMBL23927738 0.80 TDP1 (0.50) KMT2ATDP1CA12CA1CA2
Toluene SCHEMBL29087078 0.80 KMT2A (0.50) KMT2ATDP1CA12CA1CA2
SCHEMBL28683220 0.80 KMT2A (0.50) KMT2ATDP1CA12CA1CA2
Thiobenzoic Acid SCHEMBL29060728 0.80 ALDH1A1 (0.51) KMT2ATDP1CA12CA1CA2
SCHEMBL21098986 0.80 NR4A2 (0.49) KMT2ATDP1CA12CA1CA2
SCHEMBL10518901 0.79 LMNA (0.62) KMT2ATDP1CA12CA1CA2
SCHEMBL5153381 0.78 KMT2A (0.79) KMT2ATDP1SLC6A2SLC6A3TSHR

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
US-5739228-A Polymerization using thionoester compounds as chain transfer agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1998-04-14 US claimed
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