Cyclohexane

Cyclohexane

SCHEMBL7679984

C1CCCCC1.C=CCC(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.45
CYP2D6 P10635 2/20 0.45
ALDH1A1 P00352 2/20 0.45
ABCC4 O15439 1/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 3/20 0.35
FFAR3 O14843 1/20 0.35
CYP2C19 P33261 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 3/20 0.31
BLM P54132 2/20 0.31
KMT2A Q03164 2/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MEN1 O00255 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP1A2 P05177 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
LDHA P00338 1/20 0.30

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
Hydrogen Peroxide SCHEMBL27498555 0.91
SCHEMBL10553508 0.91 ALDH1A1 (0.53) ALOX15CYP2D6ALDH1A1ABCC4MAPT
SCHEMBL23108 0.91
SCHEMBL9335555 0.91 ALDH1A1 (0.53) ALOX15CYP2D6ALDH1A1ABCC4MAPT
SCHEMBL10554896 0.91 ALDH1A1 (0.53) ALOX15CYP2D6ALDH1A1ABCC4MAPT
Bromide SCHEMBL11761228 0.88
Ammonia Solution, Strong SCHEMBL462357 0.88
SCHEMBL9860296 0.88
Methane SCHEMBL20636856 0.88
SCHEMBL5908818 0.88 ALDH1A1 (0.50) ALOX15CYP2D6ALDH1A1ABCC4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261675-A2 PHOSPHATE ESTER HYDRAULIC FLUIDS WITH IMPROVED PROPERTIES ExxonMobil Research and Engineering Company (US) 2002-12-04 EP disclosed
WO-2001062879-A2 PHOSPHATE ESTER HYDRAULIC FLUIDS WITH IMPROVED PROPERTIES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2001-08-30 WO disclosed