1-Hexanol

1-Hexanol

SCHEMBL28875247

CC(C)=O.CCCCCCO.Cc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
NAAA Q02083 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX1 P07099 3/20 0.42
EPHX2 P34913 1/20 0.42
HTT P42858 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
Heptane SCHEMBL2077664 0.92 CES2 (0.52) LMNAALDH1A1TSHRCES2CES1
Dodecanol SCHEMBL12493119 0.92 LMNA (0.56) LMNAALDH1A1TSHRHSD17B10MEN1
1-Hexanol SCHEMBL9342119 0.92 LMNA (0.56) LMNAALDH1A1TSHRHSD17B10MEN1
Octanol SCHEMBL9422697 0.92 LMNA (0.56) LMNAALDH1A1TSHRHSD17B10MEN1
Cetyl Alcohol SCHEMBL29044103 0.92 LMNA (0.56) LMNAALDH1A1TSHRHSD17B10MEN1
Toluene SCHEMBL1487693 0.90 CES2 (0.47) LMNAALDH1A1TSHRMEN1KMT2A
Toluene SCHEMBL2357321 0.90 CES2 (0.50) LMNAALDH1A1TSHRMEN1KMT2A
Toluene SCHEMBL11460206 0.90 SMN1; SMN2 (0.55) LMNAALDH1A1TSHRHSD17B10MEN1
Octanol SCHEMBL19747551 0.89 CES2 (0.44) LMNAALDH1A1TSHRHSD17B10MEN1
Toluene SCHEMBL8853666 0.88 CES2 (0.48) LMNAALDH1A1TSHRMEN1KMT2A

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-110092870-A Dyestuff binders composition 沧州硕金生物科技有限公司 2019-08-06 CN disclosed