Octanol

Octanol

SCHEMBL8623758

C=CO.CCCCCCCCO

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.72
LMNA P02545 3/20 0.72
ALDH1A1 P00352 3/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
HSD17B10 Q99714 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.67
THRB P10828 2/20 0.44
DNM1 Q05193 2/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
FAAH O00519 1/20 0.38

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
Dodecanol SCHEMBL11631535 1.00 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Cetostearyl Alcohol SCHEMBL28180329 1.00 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Cetostearyl Alcohol SCHEMBL28119730 0.89 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
1-Hexanol SCHEMBL28299651 0.89 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Octanol SCHEMBL5159414 0.89 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Dodecanol SCHEMBL10801052 0.89 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Myristyl Alcohol SCHEMBL27619355 0.89 TSHR (0.72) TSHRLMNAALDH1A1MEN1KMT2A
Dodecanol SCHEMBL28619412 0.86 TSHR (0.68) TSHRLMNAALDH1A1MEN1KMT2A
Dodecanol SCHEMBL9228924 0.86 TSHR (0.68) TSHRLMNAALDH1A1MEN1KMT2A
1-Hexanol SCHEMBL10939232 0.85

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-5767127-A BACTERICIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-06-16 US disclosed