SCHEMBL8559815

SCHEMBL8559815

CCOC(=O)c1ccc(COC(=S)c2ccc(OC)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
LMNA P02545 2/20 0.52
ESR2 Q92731 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
ESR1 P03372 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MAOB P27338 1/20 0.51
TBXAS1 P24557 2/20 0.51
CYP1A2 P05177 1/20 0.50

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 0.89 CA1 (0.62) MEN1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL1303551 0.84 NPC1 (0.68) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL16689961 0.83 KMT2A (0.67) MEN1KMT2AMAPTSMN1; SMN2NPC1
4-Methoxybenzoic Acid Ethyl Ester SCHEMBL203475 0.83 CA1 (0.66) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL11458535 0.82 KMT2A (0.63) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
4-Methoxybenzoic Acid Ethyl Ester SCHEMBL27605414 0.82 CA1 (0.63) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL16704815 0.81 MAPT (0.60) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL27881866 0.81 MAPT (0.60) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL8558996 0.79 NPC1 (0.54) MEN1KMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL1129093 0.79 MEN1 (0.77) MEN1KMT2AMAPTSMN1; SMN2NPC1

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