Nonane

Nonane

SCHEMBL5676349

CCCCCCCCC.S

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.89
THRB P10828 1/20 0.89
SLC22A1 O15245 3/20 0.69
ALDH1A1 P00352 3/20 0.64
HSD17B10 Q99714 2/20 0.64
TP53 P04637 1/20 0.64
CYP3A4 P08684 1/20 0.64
ALOX15 P16050 1/20 0.64
ALOX12 P18054 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
HIF1A Q16665 1/20 0.64
SLC22A2 O15244 1/20 0.61
DNM1 Q05193 3/20 0.60
LMNA P02545 2/20 0.60
HTT P42858 1/20 0.60

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
Hexadecane SCHEMBL11732186 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Decane SCHEMBL7147766 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Dodecane SCHEMBL4004868 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Octane SCHEMBL4197161 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Undecane SCHEMBL20944699 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Undecane SCHEMBL5678872 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Tetradecane SCHEMBL5676687 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Decane SCHEMBL4005469 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Octane SCHEMBL3882561 1.00 TSHR (0.89) TSHRTHRBSLC22A1ALDH1A1HSD17B10
Heptane SCHEMBL5678844 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2860197-B1 Nitrile rubbers with low emissions ARLANXEO DEUTSCHLAND GMBH (DE) 2017-04-19 EP disclosed
EP-2860197-A1 Nitrile rubbers with low emissions LANXESS Deutschland GmbH (DE) 2015-04-15 EP disclosed
EP-2860196-A1 Nitrile rubbers with low emissions LANXESS Deutschland GmbH (DE) 2015-04-15 EP disclosed
CN-101883818-B Rubber composition for tire SUMITOMO RUBBER IND 2012-05-30 CN disclosed
CN-101883818-A Rubber composition for tire SUMITOMO RUBBER IND 2010-11-10 CN disclosed
EP-1306226-B1 Ink-jet recording sheet FUJI PHOTO FILM CO LTD (JP) 2006-02-22 EP disclosed
EP-1306226-A2 Ink-jet recording sheet FUJI PHOTO FILM CO., LTD. (JP) 2003-05-02 EP disclosed