SCHEMBL2208670

SCHEMBL2208670

CCCC[Sn](CCCC)(CCCC)CCCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.61
GPR84 Q9NQS5 7/20 0.58
PPARG P37231 7/20 0.58
PPARD Q03181 7/20 0.58
PPARA Q07869 7/20 0.58
HDAC11 Q96DB2 5/20 0.58
TSHR P16473 4/20 0.58
PTPN1 P18031 3/20 0.58
FABP4 P15090 3/20 0.58
ALDH1A1 P00352 2/20 0.58
TLR2 O60603 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
KMT2A Q03164 2/20 0.58
ALOX15 P16050 2/20 0.58
HSD17B10 Q99714 2/20 0.58
SLC22A6 Q4U2R8 1/20 0.58
SLC22A8 Q8TCC7 1/20 0.58
MEN1 O00255 1/20 0.58
ESR1 P03372 1/20 0.58
PDE4A P27815 1/20 0.58

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
Dodecanoate SCHEMBL30063291 0.91 GPR84 (0.74) AKR1B1GPR84PPARGPPARDPPARA
Dodecanoate SCHEMBL28448608 0.91 GPR84 (0.74) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL9723621 0.91 AKR1B1 (0.54) AKR1B1GPR84PPARGPPARDPPARA
Decanoic Acid SCHEMBL29154620 0.89 GPR84 (0.71) AKR1B1GPR84PPARGPPARDPPARA
Octanoic Acid SCHEMBL28503007 0.89 GPR84 (0.71) AKR1B1GPR84PPARGPPARDPPARA
Dodecanoate SCHEMBL29407565 0.86 GPR84 (0.74) AKR1B1GPR84PPARGPPARDPPARA
Hexanoate SCHEMBL23672283 0.85 AKR1B1 (0.67) AKR1B1GPR84PPARGPPARDPPARA
Hexanoate SCHEMBL28308804 0.85 AKR1B1 (0.67) AKR1B1GPR84PPARGPPARDPPARA
Acetic Acid SCHEMBL18831279 0.82 AKR1B1 (0.42) AKR1B1GPR84PPARGPPARDPPARA
Valeric Acid SCHEMBL1331662 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103261300-B Comprise hydrazides, hydrazone and polyamines based on natural rubber and the compositions of white carbon black 米其林集团总公司 2016-08-10 CN disclosed
US-8815998-B2 Modified natural rubber, production process for the same and rubber composition and tire prepared by using the same BRIDGESTONE CORPORATION (JP) 2014-08-26 US disclosed
EP-2348055-B1 MODIFIED NATURAL RUBBER AND METHOD FOR PRODUCING MODIFIED NATURAL RUBBER, AND RUBBER COMPOSITION AND TIRE USING THE SAME BRIDGESTONE CORP (JP) 2014-02-12 EP disclosed
CN-103261300-A Composition based on natural rubber and carbon black comprising hydrazide, hydrazone and polyamine MICHELIN RECH TECH 2013-08-21 CN disclosed
US-20110224365-A1 MODIFIED NATURAL RUBBER, PRODUCTION PROCESS FOR THE SAME AND RUBBER COMPOSITION AND TIRE PREPARED BY USING THE SAME BRIDGESTONE CORPORATION (JP) 2011-09-15 US disclosed
EP-2348055-A1 MODIFIED NATURAL RUBBER AND METHOD FOR PRODUCING MODIFIED NATURAL RUBBER, AND RUBBER COMPOSITION AND TIRE USING THE SAME Bridgestone Corporation (JP) 2011-07-27 EP disclosed
EP-1408941-B1 USE OF A PHARMACEUTICAL COMPOSITION COMPRISING TWO QUATERNARY AMMONIUM COMPOUNDS AND AN ORGANOMETALLIC ONE IN THE TREATMENT OF VIRAL AND FUNGAL INFECTIONS AND DISEASES ZETETIC RES INC (US) 2007-05-09 EP disclosed
EP-1408941-A4 PHARMACEUTICAL COMPOSITION AND METHOD OF USING THE SAME ZETETIC RES INC (US) 2006-01-25 EP disclosed
EP-1408941-A2 PHARMACEUTICAL COMPOSITION AND METHOD OF USING THE SAME ZETETIC RESEARCH, INC. (US) 2004-04-21 EP disclosed
US-6462079-B2 ALKYL-DIMETHYL-BENZYL- AND ALKYL-DIMETHYL-ETHYLBENZYL-AMMONIUM CHLORIDES, AND AN ORGANOTIN COMPOUND AS VIRICIDES BACTERICIDES AND FUNGICIDES ZETETIC RESEARCH, INC. 2002-10-08 US disclosed
US-6420421-B1 ALKYL-DIMETHYL-BENZYL OR ETHYLBENZYL AMMONIUM CHLORIDE MIXTURE AND BIS(TRI-N-BUTYLTIN)OXIDE; USED TO TREAT VIRAL, BACTERIAL AND FUNGAL INFECTIONS IN MAMMALS AND AVIANS ZETETIC RESEARCH, INC. 2002-07-16 US disclosed
US-20020061926-A1 Pharmaceutical composition and method of using the same PHILLIPS MARK W (US) 2002-05-23 US disclosed
WO-2001051603-A2 PHARMACEUTICAL COMPOSITION AND METHOD OF USING THE SAME ZETETIC RESEARCH, INC. (US) 2001-07-19 WO disclosed
US-4021537-A ALKYL DIMETHYL BENZYL AMMONIUM HALIDE, ESTER OF BIS(TRI-N-BUTYLTIN)OXIDE RESEARCH LAB PRODUCTS, INC. (US) 1977-05-03 US disclosed