SCHEMBL27559738

SCHEMBL27559738

CCC(=O)CCCOCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ PLA2G2C Q5R387 2/20 0.33
▸ SPHK1 Q9NYA1 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SPHK2 Q9NRA0 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ TLR2 O60603 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ TSHR P16473 2/20 0.31
▸ LPAR5 Q9H1C0 1/20 0.31

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
SCHEMBL25832655 0.83 TDP1 (0.45) CYP3A4TDP1HTTTSHR
SCHEMBL18812955 0.81 HSD17B10 (0.50) CYP1A2CYP3A4CYP2C19TDP1HSD17B10
SCHEMBL12299382 0.81 TDP1 (0.43) CYP3A4TDP1HTTTSHR
SCHEMBL6398251 0.79 SPHK2 (0.37) CYP1A2CYP3A4CYP2C19HSD17B10PLA2G2C
SCHEMBL26997903 0.79 TSHR (0.38) CYP1A2CYP3A4CYP2C19TDP1HSD17B10
SCHEMBL16968083 0.79 ALDH1A1 (0.43) TDP1HTTTSHR
SCHEMBL15219012 0.77 TSHR (0.50) CYP3A4TDP1HTTTSHR
SCHEMBL16968094 0.77 TSHR (0.39) CYP1A2CYP3A4CYP2C19TDP1HSD17B10
SCHEMBL27538553 0.77 TDP1 (0.39) TDP1TSHR
SCHEMBL12299381 0.76 TDP1 (0.43) TDP1HTTTSHR

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101631832-A Photocurable compositions for preparing ABS-like articles HUNTSMAN ADV MAT SWITZERLAND 2010-01-20 — — CN claimed
CN-103923438-A Resin Composition For Laminating And Use Thereof NIPPON CATALYTIC CHEM IND 2014-07-16 — — CN disclosed
CN-103666108-A Inkjet ink composition and method for producing the same, inkjet recording method, pigment dispersion for inkjet ink and method for producing the same FUJIFILM CORP 2014-03-26 — — CN disclosed
CN-102272227-B Radiation curable resin composition and rapid three-dimensional imaging method using the same DSM IP ASSETS BV 2014-03-12 — — CN disclosed
CN-103415540-A Photosensitive composition, cured article, and method for producing actinically cured article SANYO CHEMICAL IND LTD 2013-11-27 — — CN disclosed
CN-103189413-A Cation-curable resin composition NIPPON CATALYTIC CHEM IND 2013-07-03 — — CN disclosed
CN-101842409-B Salt compound, cationic polymerization initiator and cationically polymerizable composition ADEKA CORP 2013-05-01 — — CN disclosed
CN-102971382-A Curable composition HUNTSMAN ADV MAT SWITZERLAND 2013-03-13 — — CN disclosed
CN-101631817-B Curable composition HUNTSMAN ADV MAT SWITZERLAND 2012-11-14 — — CN disclosed
CN-102666612-A transparent fluoropolymer UNIV IBARAKI 2012-09-12 — — CN disclosed
CN-101631832-A Photocurable compositions for preparing ABS-like articles HUNTSMAN ADV MAT SWITZERLAND 2010-01-20 — — CN disclosed
CN-101591417-A Curable compositions and its quick molding method of use DSM IP ASSETS BV (NL) 2009-12-02 — — CN disclosed
CN-100523030-C Curable composition and rapid prototyping process using same DSM IP ASSETS BV (NL) 2009-08-05 — — CN disclosed
CN-101205082-A Process for producing titanium-containing metal oxide, hologram recording material, process for producing the same, and hologram recording medium TDK CORP (JP) 2008-06-25 — — CN disclosed
CN-101191027-A Ink composition, two-pack curing ink composition set, and recording method and recorded matter using these SEIKO EPSON CORP (JP) 2008-06-04 — — CN disclosed
CN-101173127-A Ink set SEIKO EPSON CORP (JP) 2008-05-07 — — CN disclosed
CN-1989145-A Novel fluorinated alkyl fluorophosphoric acid onium salts and transition metal complex salts SAN APRO LTD (JP) 2007-06-27 — — CN disclosed
CN-1705691-A Curable composition and rapid prototyping process using same DSM IP ASSETS BV (NL) 2005-12-07 — — CN disclosed
CN-1397588-A Photocationic solidified resin compsn. and its application MITSUI CHEMICALS INC (JP) 2003-02-19 — — CN disclosed
CN-1354763-A Resin composition for photofabrication of three dimensional objects DSM NV (NL) 2002-06-19 — — CN disclosed
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