Dodecane

Dodecane

SCHEMBL28181727

C=CC(N)=O.CCCCCCCCCCCC

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.58
ALDH1A1 P00352 2/20 0.58
FGFR4 P22455 1/20 0.58
ZDHHC20 Q5W0Z9 1/20 0.54
ZDHHC2 Q9UIJ5 1/20 0.54
FAAH O00519 4/20 0.50
SOAT1 P35610 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
HPGD P15428 1/20 0.46
CES2 O00748 3/20 0.46
CES1 P23141 3/20 0.46
KDM4E B2RXH2 2/20 0.45
THRA P10827 3/20 0.44
THRB P10828 3/20 0.44
SLC22A6 Q4U2R8 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
Octane SCHEMBL732968 1.00 TSHR (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Decane SCHEMBL732597 1.00 TSHR (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Dodecane SCHEMBL732866 1.00 TSHR (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Hexane SCHEMBL27979469 0.97 TSHR (0.61) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Hexane SCHEMBL8370312 0.95 TSHR (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Acrylamide SCHEMBL21247448 0.92 TSHR (0.61) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Hexadecylamine SCHEMBL28989896 0.91 DNM1 (0.56) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Dodecylamine SCHEMBL27881804 0.91 DNM1 (0.56) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Octadecylamine SCHEMBL28989922 0.91 DNM1 (0.56) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Acrylamide SCHEMBL27991533 0.91 DNM1 (0.56) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106133105-B Composition for polishing and use its Ginding process 福吉米株式会社 2018-04-03 CN disclosed
CN-107254211-A High-end water paint modified nano calcium carbonate raw powder's production technology 河北科技大学 2017-10-17 CN disclosed