SCHEMBL4291079

SCHEMBL4291079

CCCCC(C)OC(=O)c1ccccc1C(=O)OC(C)CCCC

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.78
CYP3A4 P08684 3/20 0.56
CA2 P00918 1/20 0.56
TSHR P16473 6/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
MAPK1 P28482 2/20 0.53
TP53 P04637 1/20 0.53
LMNA P02545 2/20 0.51
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
SCN1A P35498 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 0.47
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.44
CTSK P43235 2/20 0.44
CTSL P07711 1/20 0.44

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
SCHEMBL29828588 1.00 ALDH1A1 (0.78) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL1014433 0.95 ALDH1A1 (0.86) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL5667479 0.94 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL29723317 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL1930571 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL21333932 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL1702480 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL9069200 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL31140049 0.93 ALDH1A1 (0.89) ALDH1A1CYP3A4CA2TSHRL3MBTL1
SCHEMBL30010658 0.91 ALDH1A1 (0.66) ALDH1A1CYP3A4CA2TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114830380-A Binder composition for nonaqueous secondary battery electrode, slurry composition for nonaqueous secondary battery electrode, electrode for nonaqueous secondary battery, and nonaqueous secondary battery 日本瑞翁株式会社 2022-07-29 CN disclosed
CN-108934182-B Conducting wire 拓自达电线株式会社 2019-12-17 CN disclosed
US-20090263744-A1 ETHYLENICALLY UNSATURATED COMPOUND, LIGHT SENSITIVE COMPOSITION, LIGHT SENSITIVE PLANOGRAPHIC PRINTING PLATE MATERIAL AND PRINTING PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2009-10-22 US disclosed
US-7249723-B2 Organic solvent dispersed nano-talc slurry NGX, INC. (US) 2007-07-31 US disclosed
WO-2007024252-A2 ORGANIC SOLVENT DISPERSED NANO-TALC SLURRY NANOMAT, INC. (US) 2007-03-01 WO disclosed
US-20060086837-A1 Dry milling talc powder, mixing the dry-milled nano-talc powder with an organic solvent andwet milling the nano-talc-solvent mix NGX, INC. 2006-04-27 US disclosed
US-7026107-B2 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2006-04-11 US disclosed
US-20050142504-A1 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. 2005-06-30 US disclosed
CN-2545021-Y Wheel spoke with color coatig and wheel spoke with multicolor coating HWASUNG GYEJON CO LTD (KR) 2003-04-16 CN disclosed
EP-0773241-B1 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO LTD (JP) 2001-09-12 EP disclosed
EP-0811639-B1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO LTD (JP) 2001-08-01 EP disclosed
US-5965478-A A POLYMERIZATION CATALYST IS A REACTION PRODUCT OF A TITANIUM HALIDE, A DIESTER OF AROMATIC DICARBOXYLIC ACID AND A DIALKOXYMAGNESIUM PARTICLES HAVING A HIGH BULK DENSITY; POLYOLEFIN HAVING A HIGH STEREOREGULARITY, HIGH BULK DENSITY TOHO TITANIUM CO., LTD. (JP) 1999-10-12 US disclosed
EP-0811639-A1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO., LTD. (JP) 1997-12-10 EP disclosed
EP-0773241-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0773240-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
US-5547912-A FROM DIALKOXYMAGNESIUM COMPOUND, ALUMINUM COMPOUND, TITANIUM TETRACHLORIDE, AND DIESTER OF AROMATIC DICARBOXYLIC ACID TOHO TITANIUM CO., LTD. (JP) 1996-08-20 US disclosed
EP-0665243-A2 Catalyst for polymerization of olefins and process for polymerization of olefins using the same TOHO TITANIUM CO., LTD. (JP) 1995-08-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090263744-A1 ETHYLENICALLY UNSATURATED COMPOUND, LIGHT SENSITIVE COMPOSITION, LIGHT SENSITIVE PLANOGRAPHIC PRINTING PLATE MATERIAL AND PRINTING PROCESS EMPLOYING THE SAME ELOVL1, ELOVL6, ELOVL3 ALDH1A1 1057/4885CYP3A4 231/4885CA2 4707/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.