Dodecane

Dodecane

SCHEMBL7125570

C1CCCCC1.CCCCCCCCCCCC

nearest known ligand 0.73

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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
Octane SCHEMBL968658 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Cyclooctane SCHEMBL8435685 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Nonane SCHEMBL17233405 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Tridecane SCHEMBL4188228 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Octane SCHEMBL20979775 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Cyclohexane SCHEMBL4939703 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Decane SCHEMBL4188227 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Nonane SCHEMBL10945513 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Heptane SCHEMBL2878903 1.00 TSHR (0.73) TSHRTHRBDNM1ALDH1A1LMNA
Heptane SCHEMBL8947820 1.00 TSHR (0.73) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109964328-A Composition for forming organic electroluminescent element, and method for producing organic film 三菱化学株式会社 2019-07-02 CN disclosed
CN-106459317-A Acrylic polymer, method for producing same, and plastisol composition including said acrylic polymer 三菱丽阳株式会社 2017-02-22 CN disclosed
US-6667083-B2 Specific ethylene-vinyl alcohol copolymer (A) and a layer of a resin blend of a thermoplastic resin having a boronic acid ester group and polypropylene; gas barrier properties, thermal stability KURARAY CO., LTD. (JP) 2003-12-23 US disclosed
US-5690993-A CELLULOSE DERIVATIVE, ALCOHOL SOLVENT XEROX CORPORATION (US) 1997-11-25 US disclosed
US-5690993-A CELLULOSE DERIVATIVE, ALCOHOL SOLVENT XEROX CORPORATION (US) 1997-11-25 US disclosed
US-5672451-A Migration imaging members XEROX CORPORATION (US) 1997-09-30 US disclosed
US-5580689-A SOLFTENABLE LAYER OF SOFTENABLE MATERIAL, PIGMENT SENSITIVE TO INFRARED OR RED LIGHT ILLUMINATION, AND MIGRATION MARKING MATERIAL XEROX CORPORATION (US) 1996-12-03 US disclosed