Hexadecane

Hexadecane

SCHEMBL27375271

CCCCCCCCCCCCCCCC.COC

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.73
THRB P10828 1/20 0.73
DNM1 Q05193 6/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HSD17B10 Q99714 1/20 0.50
SLC22A1 O15245 1/20 0.50

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
Heptane SCHEMBL447146 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Octane SCHEMBL4441366 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Undecane SCHEMBL28043835 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Decane SCHEMBL3182487 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Hexane SCHEMBL5498517 0.95
Decane SCHEMBL3423072 0.89 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Hexadecane SCHEMBL23499901 0.85 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Decane SCHEMBL23499900 0.85 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Heptane SCHEMBL10948326 0.85 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Tetradecane SCHEMBL23924271 0.85 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114341477-A Cold start for high octane fuel in diesel engine architecture 清焰发动机公司 2022-04-12 CN disclosed
CN-110486151-A A kind of dimethyl ether compression ignition RC engine and its control method UNIV BEIJING TECHNOLOGY 2019-11-22 CN disclosed
CN-110257110-A It is a kind of based on dimethyl ether be raw material vehicle fuel 浙江天顺生物科技有限公司 2019-09-20 CN disclosed
CN-103257216-B A kind of measurement mechanism of cetane number of fuel XI'AN JIAOTONG UNIVERSITY (CN) 2015-12-02 CN disclosed
CN-103257216-A Measurement device of fuel cetane numbers UNIV XI AN JIAOTONG 2013-08-21 CN disclosed
CN-101628241-B Monolithic catalyst for dimethyl ether catalytic combustion and preparation method and application thereof UNIV GUANGDONG TECHNOLOGY 2011-11-09 CN disclosed
CN-101240203-B Catalyst for dimethyl ether catalytic combustion and its preparation method and application UNIV GUANGDONG TECHNOLOGY 2011-03-02 CN disclosed
CN-101852448-A Application of hydrogenated nitrile rubber in gas appliance using dimethyl ether as fuel QIBIAO XIE 2010-10-06 CN disclosed
CN-101628241-A Monolithic catalyst for dimethyl ether catalytic combustion and preparation method and application thereof UNIV GUANGDONG TECHNOLOGY 2010-01-20 CN disclosed
CN-1106859-C Improvements in or relating to contrast agents NYCOMED IMAGING AS (NO) 2003-04-30 CN disclosed
CN-1072521-C Polymeric surfactant-encapsulated microbubbles and their use in ultrasound imageing NYCOMED IMAGING AS (NO) 2001-10-10 CN disclosed
CN-1238699-A Improvements in or relating to contrast agents NYCOMED IMAGING AS (NO) 1999-12-15 CN disclosed
CN-1136285-A Polymeric surfactant-encapsulated microbubbles and their use in ultrasound imageing NYCOMED IMAGING AS (NO) 1996-11-20 CN disclosed