SCHEMBL5000541

SCHEMBL5000541

O=C(O)CCCOc1cccs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.51
NPC1 O15118 2/20 0.49
TSHR P16473 3/20 0.45
POLB P06746 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
PPARA Q07869 2/20 0.41
LTA4H P09960 1/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC3 O15379 1/20 0.40
MAPK1 P28482 1/20 0.40
ADRA1A P35348 1/20 0.40
HDAC4 P56524 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC1 Q13547 1/20 0.40

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
SCHEMBL4989913 0.95 HPGD (0.54) HPGDNPC1TSHRPOLBTDP1
SCHEMBL4991638 0.93 HPGD (0.57) HPGDNPC1TSHRPOLBTDP1
SCHEMBL1418443 0.91 LMNA (0.50) HPGDNPC1TSHRPOLBTDP1
SCHEMBL341114 0.79 ALOX15 (0.50) HPGDPOLBTDP1LMNAALDH1A1
SCHEMBL27766082 0.78 HPGD (0.55) HPGDNPC1TSHRPOLBTDP1
SCHEMBL6439988 0.78 ALDH1A1 (0.35) HPGDNPC1TSHRPOLBLTA4H
SCHEMBL11290456 0.77 PTPN1 (0.35) HPGDNPC1TSHRPOLBLMNA
SCHEMBL4612959 0.77 GPR84 (0.41) HPGDNPC1POLBTDP1L3MBTL1
SCHEMBL4614540 0.76 MMP12 (0.41) HPGDNPC1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL20912415 0.76 LMNA (0.38) HPGDNPC1TSHRPOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11269251-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-03-08 US disclosed
US-20190113844-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-04-18 US disclosed
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
EP-1253162-B1 Polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefore; charge control agent, toner binder and toner containing same; image forming method and image forming apparatus using the toner CANON KK (JP) 2006-04-19 EP 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-6808854-B2 PRODUCED BY OXIDIZING WITH A PEROXIDE A BIOSYNTHETIC POLYHYDROXYALKANOATE; BIODEGRADABLE CANON KABUSHIKI KAISHA (JP) 2004-10-26 US disclosed
US-20030100700-A1 Novel polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefor; charge control agent, toner binder and toner containing same; and image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2003-05-29 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-1253162-A2 Polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefore; charge control agent, toner binder and toner containing same; image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2002-10-30 EP 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