SCHEMBL8000106

SCHEMBL8000106

CCN(CC)CC.O=C(O)N(S)S

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
ALDH1A1 P00352 4/20 0.32
HDAC8 Q9BY41 2/20 0.32
HDAC6 Q9UBN7 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
AGTR1 P30556 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GLA P06280 2/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 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
Bicarbonate SCHEMBL378701 0.81 FFAR3 (0.44) FFAR3CHRM2CHRM4CHRM5CHRM1
Bicarbonate SCHEMBL60768 0.81 FFAR3 (0.44) FFAR3CHRM2CHRM4CHRM5CHRM1
Oxalic Acid SCHEMBL1840973 0.78 FFAR3 (0.41) FFAR3CHRM2CHRM4CHRM5CHRM1
Bicarbonate SCHEMBL4800891 0.78 FFAR3 (0.41) FFAR3CHRM2CHRM4CHRM5CHRM1
Acetic Acid SCHEMBL19356582 0.78 FFAR3 (0.50) FFAR3CHRM2CHRM4CHRM5CHRM1
Acetic Acid SCHEMBL22152 0.78 FFAR3 (0.50) FFAR3CHRM2CHRM4CHRM5CHRM1
Bicarbonate SCHEMBL4312446 0.78 FFAR3 (0.41) FFAR3CHRM2CHRM4CHRM5CHRM1
Oxalic Acid SCHEMBL216302 0.78 FFAR3 (0.41) FFAR3CHRM2CHRM4CHRM5CHRM1
Acetic Acid SCHEMBL16244302 0.78 FFAR3 (0.50) FFAR3CHRM2CHRM4CHRM5CHRM1
Bicarbonate SCHEMBL4800886 0.78 FFAR3 (0.41) FFAR3CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5002674-A Ashless thiophosphates derived from dihydrocarbyl dithiocarbamates; wear and oxidation resistance in internal combustion engines MOBIL OIL CORPORATION (US) 1991-03-26 US claimed
US-4919830-A Dithiocarbamate-derived phosphates as antioxidant/antiwear multifunctional additives MOBIL OIL CORPORATION (US) 1990-04-24 US claimed
CN-104829632-A Cephalosporin derivative containing dithiocarbamic acid substituent group UNIV SUN YAT SEN 2015-08-12 CN disclosed
CN-102229551-B Method for preparing isothiocyanate UNIV ZHEJIANG TECHNOLOGY 2014-07-02 CN disclosed
CN-102229551-A Method for preparing isothiocyanate UNIV ZHEJIANG TECHNOLOGY 2011-11-02 CN disclosed
US-6287821-B1 NUCLEOTIDE HAVING CLEAVABLE LINKING GROUP, SPACER LINKING GROUP, AND REPORTER MOLECULE ATTACHED AT 3' POSITION; REPORTER MOLECULE HAS GREATER FLUORESCENCE WHEN UNATTACHED FROM NUCLEOTIDE; SENSITIVE AMPLIFICATION OF SIGNAL ORCHID BIOSCIENCES, INC. 2001-09-11 US disclosed
WO-1999064437-A1 NUCLEOTIDE ANALOGUES WITH 3'-PRO-FLUORESCENT FLUOROPHORES IN NUCLEIC ACID SEQUENCE ANALYSIS ORCHID BIOSCIENCES, INC. (US) 1999-12-16 WO disclosed
US-5605663-A Aromatic acids CIBA-GEIGY CORPORATION (US) 1997-02-25 US disclosed
US-5587461-A Aromatic acids CIBA-GEIGY CORPORATION (US) 1996-12-24 US disclosed
US-5382659-A Aromatic acids CIBA-GEIGY CORP. (US) 1995-01-17 US disclosed
US-5229503-A Lysine-n-amino reactive and cysteine-mercapto reactive azo dyes CIBA-GEIGY CORPORATION (US) 1993-07-20 US disclosed
EP-0128594-B1 PHOTOGRAPHIC ELEMENTS FOR SILVER SALT DIFFUSION TRANSFER PROCESS FUJI PHOTO FILM CO., LTD. (JP) 1988-01-07 EP disclosed
US-4676924-A Liquid crystalline isothiocyanates with dioxane ring and liquid crystalline admixtures containing same WOJSKOWA AKADEMIA TECHNICZNA (PL) 1987-06-30 US disclosed
EP-0126883-B1 LIQUID CRYSTALLINE CYCLOHEXYLBENZENE DERIVATIVES, THEIR PREPARATION AND THE LIQUID CRYSTAL COMPOSITIONS CONTAINING THEM Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) 1987-03-11 EP disclosed
US-4610954-A ANTIFOGGING AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1986-09-09 US disclosed
US-4569899-A Photographic element for silver salt diffusion transfer process FUJI PHOTO FILM CO., LTD. (JP) 1986-02-11 US disclosed
EP-0170082-A2 Liquid crystalline isothiocyanates with a dioxane ring and liquid crystalline admixtures containing the same Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) 1986-02-05 EP disclosed
US-4520096-A Photographic elements for silver salt diffusion transfer process containing mercapto imidazole stabilizers FUJI PHOTO FILM CO., LTD. (JP) 1985-05-28 US disclosed
EP-0128594-A2 Photographic elements for silver salt diffusion transfer process FUJI PHOTO FILM CO., LTD. (JP) 1984-12-19 EP disclosed
EP-0126883-A1 Liquid crystalline cyclohexylbenzene derivatives, their preparation and the liquid crystal compositions containing them Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) 1984-12-05 EP disclosed