Decane

Decane

SCHEMBL5015979

CCCCCCCCCC.O=P(O)(O)O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Decane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.68
LPAR2 Q9HBW0 3/20 0.68
FDPS P14324 11/20 0.59
GGPS1 O95749 6/20 0.59
LPAR1 Q92633 2/20 0.59
TSHR P16473 1/20 0.57
THRB P10828 1/20 0.57

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
Phosphoric Acid SCHEMBL11131007 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL4445679 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Hexadecane SCHEMBL3437134 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Dodecane SCHEMBL1262800 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Phosphoric Acid SCHEMBL11052344 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Decane SCHEMBL16986478 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL9461155 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Dodecane SCHEMBL11581918 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL21854612 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL3458550 1.00 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147404-A1 Invertible well bore servicing fluid HALLIBURTON ENERGY SERVICES, INC. 2004-07-29 US claimed
WO-2023122374-A1 LUBRICATING OIL COMPOSITION HAVING RESISTANCE TO ENGINE DEPOSITS AFTON CHEMICAL CORPORATION (US) 2023-06-29 WO disclosed
CN-115255358-A Surface modification method of metal powder material, modified metal powder material and application thereof 西安隆基乐叶光伏科技有限公司 2022-11-01 CN disclosed
EP-2866297-B1 DYE-SENSITIZED SOLAR CELL NIPPON CHEMICON (JP) 2021-01-06 EP disclosed
CN-105188639-B Dentistry primary coat agent formulation 义获嘉伟瓦登特公司 2018-07-13 CN disclosed
US-20170292083-A1 TBN and Performance Booster AFTON CHEMICAL CORPORATION (US) 2017-10-12 US disclosed
US-20150332858-A2 DYE-SENSITIZED SOLAR CELL NIPPON CHEMI-CON CORPORATION (JP) 2015-11-19 US disclosed
WO-2015168616-A1 NEURONAL NICOTINIC AGONISTS AND METHODS OF USE ABBVIE INC. (US) 2015-11-05 WO disclosed
US-20150187511-A1 DYE-SENSITIZED SOLAR CELL NIPPON CHEMI-CON CORPORATION (JP) 2015-07-02 US disclosed
EP-2866297-A1 DYE-SENSITIZED SOLAR CELL Nippon Chemi-Con Corporation (JP) 2015-04-29 EP disclosed
CN-1040818-A The composition that contains active sulphur LUBRIZOL CORP (US) 1990-03-28 CN disclosed
CN-1040216-A Lubricating oil composition and enriched material LUBRIZOL CORP (US) 1990-03-07 CN disclosed
CN-1039837-A Lubricating oil composition and enriched material LUBRIZOL CORP (US) 1990-02-21 CN disclosed
US-4894174-A Anti-oxidant compositions THE LUBRIZOL CORPORATION (US) 1990-01-16 US disclosed
WO-1988009804-A2 ANTI-OXIDANT COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1988-12-15 WO disclosed
EP-0291521-A1 SULFUR-CONTAINING COMPOSITIONS, LUBRICANT, FUEL AND FUNCTIONAL FLUID COMPOSITIONS. LUBRIZOL CORP (US) 1988-11-23 EP disclosed
US-4764299-A Anti-oxidant compositions THE LUBRIZOL CORPORATION (US) 1988-08-16 US disclosed
WO-1988003552-A2 SULFUR-CONTAINING COMPOSITIONS, LUBRICANT, FUEL AND FUNCTIONAL FLUID COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1988-05-19 WO disclosed
CN-87102960-A Lubricant compositions 1988-01-20 CN disclosed
CN-87100331-A Be used to control the lubricant compositions that contains transition metal of viscosity 1987-09-16 CN disclosed