SCHEMBL2338549

SCHEMBL2338549

CCC(OC(=O)OC(CC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.47
HIF1A Q16665 1/20 0.47
KCNN4 O15554 1/20 0.42
CHRM2 P08172 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41
CYP1A2 P05177 3/20 0.40
CYP2D6 P10635 2/20 0.40
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
KIF11 P52732 1/20 0.39
CES1 P23141 1/20 0.39
DRD2 P14416 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL2338554 0.88 CYP2C19 (0.47) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL2342432 0.85 CYP2C19 (0.44) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL13346886 0.82 CYP2C19 (0.46) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL9806653 0.82 HIF1A (0.44) CYP2C19HIF1AKCNN4CYP1A2CYP2D6
SCHEMBL29288247 0.80 KCNN4 (0.41) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL13387222 0.80 TSHR (0.49) CYP2C19HIF1ACHRM3KMT2ACES1
SCHEMBL13346885 0.79 CYP1A2 (0.41) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL2484068 0.78 CYP1A2 (0.48) CYP2C19HIF1ACHRM1CHRM3CYP1A2
SCHEMBL23762836 0.78 CYP2C19 (0.42) CYP2C19HIF1AKCNN4CHRM2CHRM1
SCHEMBL18203958 0.77 L3MBTL1 (0.44) CYP2C19HIF1AKCNN4CHRM2CHRM1

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
CN-113234054-A Dialkyl carbonates, methods of making and using the same 亨斯迈石油化学有限责任公司 2021-08-10 CN disclosed
EP-1640357-B1 METHOD FOR PRODUCING AROMATIC CARBONATE ASAHI KASEI CHEMICALS CORP (JP) 2011-08-31 EP disclosed
US-7652122-B2 Method for producing an aromatic carbonate ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-01-26 US disclosed
US-20070055042-A1 Method for producing an aromatic carbonate ASAHI KASEI KABUSHIKI KAISHA (JP) 2007-03-08 US disclosed
EP-1640357-A1 METHOD FOR PRODUCING AROMATIC CARBONATE Asahi Kasei Chemicals Corporation (JP) 2006-03-29 EP disclosed