Hexadecane

Hexadecane

SCHEMBL346740

CCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCC.OP(O)(O)=S.OP(O)(O)=S.[Zn]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 10/20 0.56
LPAR2 Q9HBW0 7/20 0.56
TSHR P16473 2/20 0.53
THRB P10828 1/20 0.53
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LPAR1 Q92633 3/20 0.45
FDPS P14324 3/20 0.44
GGPS1 O95749 1/20 0.44

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 SCHEMBL164654 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Dodecane SCHEMBL164251 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Nonane SCHEMBL163989 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Octane SCHEMBL11538781 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Tridecane SCHEMBL346366 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Decane SCHEMBL164629 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Tetradecane SCHEMBL345933 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Dodecane SCHEMBL20855474 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Undecane SCHEMBL21044746 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA
Octane SCHEMBL163341 1.00 LPAR3 (0.56) LPAR3LPAR2TSHRTHRBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4171558-A Cutting oil composition for processing cemented carbide skiving hob IDEMITSU KOSAN CO., LTD. (JP) 1979-10-23 US claimed
EP-1612258-B1 Use of additives in a lubricant composition for automotive driving system TONENGENERAL SEKIYU KK (JP) 2018-11-21 EP disclosed
US-20120012076-A1 METHOD OF OPERATING A HYBRID ENGINE CASTROL LIMITED (GB) 2012-01-19 US disclosed
WO-2010046620-A1 METHOD OF OPERATING A HYBRID ENGINE CASTROL LIMITED (GB) 2010-04-29 WO disclosed
EP-2177596-A1 Method of operating a hybrid engine Castrol Limited (GB) 2010-04-21 EP disclosed
US-7399736-B2 Low viscosity, high abrasion resistance engine oil composition TONENGENERAL SEKIYU K.K. (JP) 2008-07-15 US disclosed
EP-1612258-A2 Lubricant composition for automotive driving system TonenGeneral Sekiyu Kabushiki Kaisha (JP) 2006-01-04 EP disclosed
US-20050267002-A1 Lubricant composition for automobile driving system KATO TOMOHIRO 2005-12-01 US disclosed
EP-1600495-A1 A low viscosity, high abrasion resistance engine oil composition TonenGeneral Sekiyu Kabushiki Kaisha (JP) 2005-11-30 EP disclosed
US-20050221998-A1 Low viscosity, high abrasion resistance engine oil composition MARUMO MIYOSHI 2005-10-06 US disclosed
US-4171558-A Cutting oil composition for processing cemented carbide skiving hob IDEMITSU KOSAN CO., LTD. (JP) 1979-10-23 US disclosed