Dodecane

Dodecane

SCHEMBL28292270

CCCCCCCCCCCC.Cc1ccccc1.S

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
TSHR P16473 1/20 0.58
ALOX12 P18054 1/20 0.58
ACHE P22303 1/20 0.58
HTT P42858 4/20 0.52
DNM1 Q05193 2/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPK1 P28482 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
PCSK9 Q8NBP7 1/20 0.45
KCNH2 Q12809 2/20 0.44
MLNR O43193 1/20 0.44
NR1I2 O75469 1/20 0.44
ESR1 P03372 1/20 0.44
NR3C1 P04150 1/20 0.44
PGR P06401 1/20 0.44
ADRB2 P07550 1/20 0.44
CHRM2 P08172 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
Decane SCHEMBL27778817 1.00 LMNA (0.58) LMNATSHRALOX12ACHEHTT
Heptane SCHEMBL27684378 1.00 LMNA (0.58) LMNATSHRALOX12ACHEHTT
Octane SCHEMBL27749919 0.97 LMNA (0.55) LMNATSHRALOX12ACHEHTT
Octane SCHEMBL11135695 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Octane SCHEMBL11193559 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Decane SCHEMBL7111192 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Heptane SCHEMBL16466974 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Heptane SCHEMBL7745742 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Heptane SCHEMBL6664964 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT
Hexadecane SCHEMBL4950420 0.97 TSHR (0.61) LMNATSHRALOX12ACHEHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109755562-A The preparation method and applications of iron nickel oxide cladding carbon material 浙江南都电源动力股份有限公司 2019-05-14 CN disclosed