Butyl Alcohol

Butyl Alcohol

SCHEMBL27800136

CCCCO.O=Cc1occc1CO

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Alcohol SCHEMBL791739 0.88 ALDH1A1 (0.33) ALDH1A1LMNA
Methyl Alcohol SCHEMBL28206337 0.86 ALDH1A1 (0.34) ALDH1A1LMNA
SCHEMBL51449 0.86
SCHEMBL28181090 0.86 ALDH1A1 (0.36) ALDH1A1LMNA
SCHEMBL19305350 0.84 ALDH1A1 (0.35) ALDH1A1LMNA
Water SCHEMBL4304540 0.84 ALDH1A1 (0.35) ALDH1A1LMNA
Methoxymethane SCHEMBL28228821 0.83 ALDH1A1 (0.32) ALDH1A1LMNA
Acetone SCHEMBL28094281 0.83 PKM (0.33) ALDH1A1LMNA
Formic Acid SCHEMBL18555293 0.83 ALDH1A1 (0.34) ALDH1A1
Hydrochloric Acid SCHEMBL28152998 0.83 ALDH1A1 (0.34) ALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101724664-B Method for preparing 5-hydroxymethyl furfural from glucose by coupling and catalyzing with isomerase/diluted hydrochloric acid UNIV TIANJIN 2012-01-11 CN claimed
CN-101724664-A Method for preparing 5-hydroxymethyl furfural from glucose by coupling and catalyzing with isomerase/diluted hydrochloric acid UNIV TIANJIN 2010-06-09 CN claimed
CN-103626639-B With metal catalyst reduction HMF ether 阿彻丹尼尔斯米德兰德公司 2016-12-07 CN disclosed
CN-101948452-B Method for producing hydroxymethylfurfural by cellulose-containing biomass SHANXI COAL CHEM INST 2012-11-14 CN disclosed
CN-101724664-B Method for preparing 5-hydroxymethyl furfural from glucose by coupling and catalyzing with isomerase/diluted hydrochloric acid UNIV TIANJIN 2012-01-11 CN disclosed
CN-101948452-A Method for producing hydroxymethylfurfural by cellulose-containing biomass INST COAL CHEMISTRY CAS 2011-01-19 CN disclosed
CN-101724664-A Method for preparing 5-hydroxymethyl furfural from glucose by coupling and catalyzing with isomerase/diluted hydrochloric acid UNIV TIANJIN 2010-06-09 CN disclosed