SCHEMBL997027

SCHEMBL997027

O=C1OC2CCCCCCCCCCCCC/C=C/12

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
HIF1A Q16665 1/20 0.32
HSD11B1 P28845 1/20 0.30

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
SCHEMBL1301127 1.00 MAPT (0.33) MAPTHIF1AHSD11B1
SCHEMBL8422167 1.00 MAPT (0.33) MAPTHIF1AHSD11B1
SCHEMBL1515669 0.88
SCHEMBL11286745 0.83
SCHEMBL1515635 0.75 MKNK2 (0.32)
SCHEMBL29475259 0.70
SCHEMBL13585913 0.67 KDM1A (0.38) HIF1AHSD11B1
SCHEMBL11076742 0.66 MAPT (0.37) MAPTHIF1AHSD11B1
SCHEMBL11076741 0.66 MAPT (0.37) MAPTHIF1AHSD11B1
SCHEMBL3397911 0.61 MAPT (0.62) MAPTHIF1AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210310033-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS AGAIN BIO APS (DK) 2021-10-07 US claimed
EP-3739057-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS Genomatica, Inc. (US) 2020-11-18 EP claimed
US-20210310033-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS AGAIN BIO APS (DK) 2021-10-07 US disclosed
US-11008597-B2 Chemo-enzymatic process GENOMATICA, INC. (US) 2021-05-18 US disclosed
EP-3739057-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS Genomatica, Inc. (US) 2020-11-18 EP disclosed
EP-3129492-B1 CHEMO-ENZYMATIC PROCESS FOR THE PREPARATION OF LACTONES AND MACROCYCLIC KETONES GENOMATICA INC (US) 2020-06-03 EP disclosed
EP-3129492-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2017-02-15 EP disclosed
US-20170029854-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2017-02-02 US disclosed
WO-2015157719-A9 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2016-08-04 WO disclosed
WO-2015157719-A1 SEMISYNTHETIC ROUTES TO ORGANIC COMPOUNDS REG Life Sciences, LLC (US) 2015-10-15 WO disclosed
US-8961946-B2 Hair processing agent and method for permanent waving hair SHOWA DENKO K.K. (JP) 2015-02-24 US disclosed
EP-2272541-A1 AROMATIC AGENT COMPOSITION FOR OPENABLE STORAGE SPACE Kobayashi Pharmaceutical Co., Ltd. (JP) 2011-01-12 EP disclosed
EP-2263700-A1 AROMATIC AGENT COMPOSITION FOR OPENABLE STORAGE SPACE Kobayashi Pharmaceutical Co., Ltd. (JP) 2010-12-22 EP disclosed
EP-1721943-B1 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORP (JP) 2010-05-12 EP disclosed
US-7538149-B2 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2009-05-26 US disclosed
US-20080085251-A1 even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; RESONAC CORPORATION (JP) 2008-04-10 US disclosed
US-20060258776-A1 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJI PHOTO FILM CO., LTD. 2006-11-16 US disclosed
EP-1721943-A1 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2006-11-15 EP disclosed
EP-1316551-A1 PROCESS FOR PREPARING EPOXY COMPOUNDS, AROMATIC COMPOSITIONS CONTAINING THE COMPOUNDS, AND DRINKS, PERFUMES, COSMETICS, CIGARETTES, AND TOBACCOS CONTAINING THE COMPOSITIONS SODA AROMATIC COMPANY, LIMITED (JP) 2003-06-04 EP disclosed
US-6525207-B1 Reacting a-halocyclododecane with Grignard reagent; epoxidation, hydrolysis; reaction of base and halohydrin in presence of phase transfer catalyst; perfumes, foods, beverages, cosmetics, tobacco SODA AROMATIC CO., LTD. (JP) 2003-02-25 US 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-20080085251-A1 even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; TST, CYSLTR1, CYSLTR2 MAPT 4300/4885HIF1A 3846/4885HSD11B1 535/4885

“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.