Octane

Octane

SCHEMBL28114785

CCCCCCCC.Cc1c[nH]c(-c2ccccc2)n1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
XDH P47989 1/20 0.40
TSHR P16473 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
DHFR P00374 1/20 0.39
HSD11B1 P28845 2/20 0.39
NR1H3 Q13133 1/20 0.39
GCGR P47871 2/20 0.38
TLR8 Q9NR97 2/20 0.38
ADORA2B P29275 1/20 0.37
KCNH2 Q12809 1/20 0.37
PDE5A O76074 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37

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
SCHEMBL28159967 0.88 TSHR (0.40) GAAMAPTTSHRGPR84HSD11B1
SCHEMBL49612 0.88 GAA (0.52) GAAMAPTNR1H3
Phosphine SCHEMBL28142196 0.86 GAA (0.50) GAAMAPTNR1H3
Pyrrole SCHEMBL28207656 0.83 MAPT (0.45) GAAMAPTNR1H3
SCHEMBL28329121 0.82 GAA (0.47) GAAMAPTNR1H3
SCHEMBL29629123 0.81 KCNH2 (0.50) MAPTGPR84DHFRHSD11B1GCGR
SCHEMBL8973267 0.81 KCNH2 (0.50) MAPTGPR84DHFRHSD11B1GCGR
SCHEMBL27724619 0.81 KCNH2 (0.50) MAPTGPR84DHFRHSD11B1GCGR
SCHEMBL3005573 0.79 KCNH2 (0.47) MAPTGPR84DHFRHSD11B1GCGR
SCHEMBL28201939 0.78 GAA (0.44) GAAMAPTNR1H3

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-105960709-B Thermally conductive sheet and semiconductor device 住友电木株式会社 2019-03-15 CN disclosed
CN-106663664-B Thermally conductive sheet and semiconductor device 住友电木株式会社 2019-01-01 CN disclosed
CN-107849351-A Heat conductive resin composition, thermally conductive sheet and semiconductor device 住友电木株式会社 2018-03-27 CN disclosed
CN-107851624-A Power module substrate, power model circuit substrate and power model 住友电木株式会社 2018-03-27 CN disclosed
CN-106663664-A Heat-conductive sheet and semiconductor device 住友电木株式会社 2017-05-10 CN disclosed
CN-106471618-A Conducting strip and semiconductor device 住友电木株式会社 2017-03-01 CN disclosed
CN-106133900-A Conducting strip and semiconductor device 住友电木株式会社 2016-11-16 CN disclosed