SCHEMBL5000520

SCHEMBL5000520

CCOC(=O)CCCCSc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
MAPT P10636 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CCR3 P51677 2/20 0.44
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
CYP1A2 P05177 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL6935056 0.99 FAAH (0.48) FAAHMAPTL3MBTL1PTGDR2NPC1
SCHEMBL11618490 0.95 MAPT (0.50) FAAHMAPTL3MBTL1PTGDR2NPC1
SCHEMBL16334378 0.85 ALDH1A1 (0.46) MAPTPTGDR2NPC1RAB9ACYP4F2
SCHEMBL20545474 0.85 RAB9A (0.52) MAPTL3MBTL1NPC1RAB9AMEN1
SCHEMBL3186828 0.84 HDAC3 (0.59) MAPTL3MBTL1PTGDR2RAB9ACYP1A2
SCHEMBL7364397 0.84 HDAC1 (0.57) MAPTPTGDR2NPC1RAB9ACYP4F2
SCHEMBL20545182 0.84 NPC1 (0.51) MAPTL3MBTL1NPC1RAB9ALMNA
SCHEMBL20545473 0.84 NPC1 (0.51) MAPTL3MBTL1NPC1RAB9ALMNA
SCHEMBL415480 0.83 ALDH1A1 (0.55) MAPTL3MBTL1PTGDR2CYP1A2MEN1
SCHEMBL7516291 0.83 ALDH1A1 (0.49) MAPTPTGDR2NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7408017-B2 Polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2008-08-05 US disclosed
US-20050250191-A1 Novel polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2005-11-10 US disclosed
US-20030013841-A1 Novel polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2003-01-16 US disclosed
EP-1236755-A2 Novel polyhydroxyalkanoate containing unit phenylsulfanyl structure in the side cahin, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and imageforming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2002-09-04 EP disclosed