SCHEMBL1783639

SCHEMBL1783639

CCCC(C)CC(C)C=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.34
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH4 P08319 1/20 0.30
ADH7 P40394 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
SCHEMBL31380929 0.95 TSHR (0.37) TSHRSMN1; SMN2
SCHEMBL1784305 0.86 TSHR (0.46) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL1781177 0.84 ADH1B (0.44) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL19270734 0.83 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL8704925 0.82 ADH1B (0.47) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL1781720 0.80 TSHR (0.40) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL1784931 0.79
SCHEMBL14899286 0.79
SCHEMBL20191710 0.79
SCHEMBL15337194 0.79 ADH1B (0.44) TSHRSMN1; SMN2ADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804402-B1 ORGANIC COMPOUNDS AND PROCESSES FOR THEIR MANUFACTURE EXXONMOBIL CHEM PATENTS INC (US) 2009-10-07 EP claimed
CN-1220667-C Organic compound and method for producing the same EXXON CHEMICAL PATENTS INC (US) 2005-09-28 CN claimed
US-6307093-B1 ESTERS OF BRANCHED C.SUB.9 ALCOHOLS SUITABLE AS PLASTICIZERS; C6 ALDEHYDE AND A SATURATED ALIPHATIC C9 ALDEHYDE; REFRIGERANT LUBRICANTS EXXONMOBIL CHEMICAL PATENTS INC. 2001-10-23 US claimed
US-6274756-B1 FROM 2,4,6-TRIMETHYLNONANOL EXXON CHEMICALS PATENTS, INC. 2001-08-14 US claimed
US-6090986-A MANUFACTURE OF A SATURATED ALIPHATIC ALDEHYDE CONTAINING A TOTAL OF 9 CARBON ATOMS WHICH COMPRISES SUBJECTING A SATURATED C6 ALDEHYDE TO AN ALDOL CONDENSATION WITH PROPANAL TO FORM AN UNSATURATED C9 ALDEHYDE, AND HYDROGENATION EXXON CHEMICAL PATENTS INC. (US) 2000-07-18 US claimed
EP-0912490-A1 ESTERS, ETHERS, AND COMPOSITIONS COMPRISING THEM EXXON CHEMICAL PATENTS INC. (US) 1999-05-06 EP claimed
CN-1175941-A Organic compound and method for producing the same EXXON CHEMICAL PATENTS INC (US) 1998-03-11 CN claimed
WO-1998003462-A1 ESTERS, ETHERS, AND COMPOSITIONS COMPRISING THEM EXXON CHEMICAL PATENTS, INC. (US) 1998-01-29 WO claimed
EP-0804402-A1 ORGANIC COMPOUNDS AND PROCESSES FOR THEIR MANUFACTURE EXXON CHEMICAL PATENTS INC. (US) 1997-11-05 EP claimed
WO-1996022268-A1 ORGANIC COMPOUNDS AND PROCESSES FOR THEIR MANUFACTURE EXXON CHEMICAL PATENTS INC. (US) 1996-07-25 WO claimed
CN-114315963-B LSH series cyclic pentapeptide ester and synthetic method and application thereof 河北科技大学 2023-11-17 CN disclosed
CN-114315963-A LSH series cyclic pentapeptide ester and synthetic method and application thereof 河北科技大学 2022-04-12 CN disclosed
US-9828469-B2 Polyimide precursor, polyimide resin film produced from said polyimide precursor, display element, optical element, light-receiving element, touch panel and circuit board each equipped with said polyimide resin film, organic EL display, and methods respectively for producing organic EL element and color filter TORAY INDUSTRIES, INC. (JP) 2017-11-28 US disclosed
US-20160222165-A1 POLYIMIDE PRECURSOR, POLYIMIDE RESIN FILM PRODUCED FROM SAID POLYIMIDE PRECURSOR, DISPLAY ELEMENT, OPTICAL ELEMENT, LIGHT-RECEIVING ELEMENT, TOUCH PANEL AND CIRCUIT BOARD EACH EQUIPPED WITH SAID POLYIMIDE RESIN FILM, ORGANIC EL DISPLAY, AND METHODS RESPECTIVELY FOR PRODUCING ORGANIC EL ELEMENT AND COLOR FILTER TORAY INDUSTRIES, INC. (JP) 2016-08-04 US disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-5998635-A CATALYTIC CYCLIZATION AN ALDEHYDE WITH A KETENE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-07 US disclosed
CN-1175941-A Organic compound and method for producing the same EXXON CHEMICAL PATENTS INC (US) 1998-03-11 CN disclosed
WO-1998002406-A1 RECYCLE AND RECOVERY OF USEFUL PRODUCTS FROM HEAVY ALDOL BY-PRODUCTS EXXON CHEMICAL PATENTS, INC. (US) 1998-01-22 WO disclosed
EP-0804402-A1 ORGANIC COMPOUNDS AND PROCESSES FOR THEIR MANUFACTURE EXXON CHEMICAL PATENTS INC. (US) 1997-11-05 EP disclosed
WO-1996022268-A1 ORGANIC COMPOUNDS AND PROCESSES FOR THEIR MANUFACTURE EXXON CHEMICAL PATENTS INC. (US) 1996-07-25 WO disclosed