SCHEMBL6561116

SCHEMBL6561116

CCCCCCCCOCC(OCCCCCCCC)OCCOC(=O)c1ccccc1C(=O)OCCOC(COCCCCCCCC)OCCCCCCCC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.65
TSHR P16473 7/20 0.65
LMNA P02545 3/20 0.65
CYP3A4 P08684 4/20 0.62
MAPK1 P28482 2/20 0.62
TP53 P04637 1/20 0.62
L3MBTL1 Q9Y468 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
HSD17B10 Q99714 2/20 0.54
KDM4E B2RXH2 2/20 0.54
POLB P06746 1/20 0.54
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
CA2 P00918 1/20 0.48
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.43

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
SCHEMBL6561262 1.00 ALDH1A1 (0.65) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6561284 1.00 ALDH1A1 (0.65) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6561327 0.97 ALDH1A1 (0.62) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6560951 0.97 ALDH1A1 (0.62) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6562482 0.97 ALDH1A1 (0.62) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL3667884 0.95 TSHR (0.63) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL1189457 0.92 TSHR (0.60) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6561282 0.91 ALDH1A1 (0.60) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6561259 0.91 ALDH1A1 (0.60) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6561113 0.91 ALDH1A1 (0.60) ALDH1A1TSHRLMNACYP3A4MAPK1

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-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