Dodecane

Dodecane

SCHEMBL5672736

CCCCCCCCCCCC.c1csc(-c2ccsc2-c2cccs2)c1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
GAA P10253 3/20 0.42
KDM4E B2RXH2 3/20 0.42
LTA4H P09960 1/20 0.39
MAPT P10636 2/20 0.38
KEAP1 Q14145 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HPGD P15428 4/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
POLB P06746 1/20 0.35
PKM P14618 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL5674018 1.00 ALDH1A1 (0.42) ALDH1A1GAAKDM4ELTA4HMAPT
Octane SCHEMBL5674531 1.00 ALDH1A1 (0.42) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL5360080 0.86 LTA4H (0.41) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL147273 0.85 KDM4E (0.42) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL365802 0.85 KDM4E (0.42) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL28386670 0.85 KDM4E (0.37) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL1543233 0.85 KDM4E (0.37) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL1414942 0.84 DPP4 (0.41) ALDH1A1GAAKDM4ELTA4HMAPT
SCHEMBL4777220 0.84 KDM4E (0.36) ALDH1A1GAAKDM4ELTA4HMAPT
Methyl Alcohol SCHEMBL6013731 0.83 ALDH1A1 (0.42) ALDH1A1GAAKDM4ELTA4HMAPT

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
US-20060234151-A1 Functional organic thin film, organic thin-film transistor, and methods for producing these SHARP KABUSHIKI KAISHA (JP) 2006-10-19 US disclosed