Octanol

Octanol

SCHEMBL28176901

CCCCCCCCO.O=CO

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.72
LMNA P02545 2/20 0.72
ALDH1A1 P00352 2/20 0.72
HSD17B10 Q99714 1/20 0.72
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.67
DNM1 Q05193 2/20 0.46
THRB P10828 1/20 0.44
EPHX1 P07099 1/20 0.44
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH4 P08319 1/20 0.44
ADH7 P40394 1/20 0.44
FAAH O00519 2/20 0.42
TRPV1 Q8NER1 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42

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
1-Hexanol SCHEMBL1047802 1.00 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Tridecan-1-Ol SCHEMBL9863316 1.00 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Cetyl Alcohol SCHEMBL8359228 1.00 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Dodecanol SCHEMBL27848422 0.97 TSHR (0.68) TSHRLMNAALDH1A1HSD17B10MEN1
1-Pentanol SCHEMBL2034248 0.97 SMN1; SMN2 (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
Cetyl Alcohol SCHEMBL27475899 0.89 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Cetyl Alcohol SCHEMBL27479769 0.89 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Tridecan-1-Ol SCHEMBL5174044 0.89 TSHR (0.72) TSHRLMNAALDH1A1HSD17B10MEN1
Formic Acid SCHEMBL11093930 0.89 FAAH (0.61) TSHRLMNAALDH1A1HSD17B10MEN1
Butyl Alcohol SCHEMBL1052989 0.88

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-107250095-A The method of separating formic from reactant mixture OXFA有限公司 2017-10-13 CN disclosed