Octanol

Octanol

SCHEMBL11434883

C=C.CCCCCCCCO

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.87
LMNA P02545 3/20 0.87
ALDH1A1 P00352 3/20 0.87
MEN1 O00255 2/20 0.87
KMT2A Q03164 2/20 0.87
HSD17B10 Q99714 1/20 0.87
SMN1; SMN2 Q16637 1/20 0.80
THRB P10828 2/20 0.53
DNM1 Q05193 2/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.46
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41

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
Tridecan-1-Ol SCHEMBL3868841 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Cetostearyl Alcohol SCHEMBL26606125 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Cetyl Alcohol SCHEMBL28663150 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Dodecanol SCHEMBL11588391 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
1-Hexanol SCHEMBL10939232 1.00
Cetyl Alcohol SCHEMBL10581574 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
1-Heptanol SCHEMBL29099911 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Ethylene SCHEMBL8094901 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Dodecanol SCHEMBL1868333 1.00 TSHR (0.87) TSHRLMNAALDH1A1MEN1KMT2A
Tridecan-1-Ol SCHEMBL3441423 0.97 TSHR (0.81) TSHRLMNAALDH1A1MEN1KMT2A

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-4223065-A POLYSILOXANE, ALKYLOXYALKYL MELAMINE, METAL SALT OF A PHOSPHATE ESTER ANTISTATIC AGENT UNITIKA LTD (JP) 1980-09-16 US disclosed