SCHEMBL7121106

SCHEMBL7121106

COC(=O)c1ccccc1-c1ccccc1OCO

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.58
SLC6A4 P31645 3/20 0.58
SLC6A2 P23975 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 2/20 0.47
HSP90AA1 P07900 1/20 0.47
MAPT P10636 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
ALDH1A1 P00352 2/20 0.46
CFTR P13569 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL4385291 0.90 SLC6A3 (0.57) SLC6A3SLC6A4L3MBTL1TSHRLMNA
SCHEMBL7174241 0.83 SLC6A3 (0.60) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL30285248 0.83 SLC6A3 (0.60) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL69464 0.82 SLC6A3 (0.67) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL7116138 0.82 SLC6A3 (0.52) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL7122370 0.81 MAPT (0.51) L3MBTL1TSHRLMNAMAPTNPSR1
SCHEMBL1638896 0.80 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL1638900 0.79 SLC6A3 (0.61) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR
SCHEMBL18617549 0.78 TDP1 (0.46) L3MBTL1LMNAHTTMAPTKDM4E
SCHEMBL9549 0.78 SLC6A3 (0.57) SLC6A3SLC6A4SLC6A2L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1016648-B1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES ASAHI CHEMICAL IND (JP) 2003-05-14 EP disclosed
US-6262210-B1 TRANSESTERIFYING DIALKYL CARBONATE, ALKYL ARYL CARBONATE OR MIXTURE WITH AROMATIC MONOHYDROXY COMPOUND IN PRESENCE OF METAL CONTAINING CATALYST TO OBTAIN HIGH BOILING POINT REACTION MIXTURE CONTAINING AROMATIC CARBONATE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-07-17 US disclosed
EP-1016648-A1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-07-05 EP disclosed