SCHEMBL6562255

SCHEMBL6562255

CCCCOC(CCC)(OCCCC)OC(=O)c1ccccc1C(=O)OC(CCC)(OCCCC)OCCCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.57
TDP1 Q9NUW8 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
CYP3A4 P08684 4/20 0.51
MAPK1 P28482 2/20 0.51
TP53 P04637 1/20 0.51
ALDH1A1 P00352 7/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 2/20 0.47
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA2 P00918 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 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
SCHEMBL6562260 0.94 TSHR (0.51) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL6562488 0.89 ALDH1A1 (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL206691 0.85 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL3667880 0.84 TSHR (0.53) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL17798226 0.82 TSHR (0.50) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL809559 0.81 TSHR (0.60) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL206694 0.81 TSHR (0.49) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL1885758 0.81 ALDH1A1 (0.49) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL206693 0.80 TSHR (0.68) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL27504444 0.78 TSHR (0.46) TSHRTDP1L3MBTL1CYP3A4MAPK1

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-1069482-B1 Conductive roller, process cartridge and image forming apparatus CANON KK (JP) 2004-05-26 EP disclosed
US-6558781-B1 Conductive roller, process cartridge and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2003-05-06 US disclosed
EP-1069482-A2 Conductive roller, process cartridge and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2001-01-17 EP disclosed
US-4085533-A IMMISCIBLE LIQUIDS EWALD ALFRED 1978-04-25 US disclosed
US-4085533-A IMMISCIBLE LIQUIDS EWALD ALFRED 1978-04-25 US disclosed