Cyclohexane

Cyclohexane

SCHEMBL11119971

C1CCCCC1.C=CNC(=O)O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL233520 0.91
Dimethylamine SCHEMBL2854253 0.82
Piperazine SCHEMBL284766 0.81 GABRP (0.32) LMNA
SCHEMBL4618776 0.80
Trimethylammonium SCHEMBL20742045 0.80 LMNA (0.33) LMNAALOX15HSD17B10
Propane SCHEMBL1536015 0.80
SCHEMBL7056633 0.78 ALDH1A1 (0.36) LMNAALOX15HSD17B10
Butane SCHEMBL1536097 0.78 TSHR (0.36) LMNAALOX15HSD17B10
Glycine SCHEMBL29013695 0.76 GLRA1 (0.50) LMNAALOX15HSD17B10
Monoethanolamine SCHEMBL2911357 0.74 ALDH1A1 (0.38) ALOX15HSD17B10

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
EP-0122453-A1 Process for the preparation of polyhydroxy compounds which contain blocked and optionally free hydroxy groups, polyhydroxy compounds obtained by this process and coating compositions based on these polyhydroxy compounds BAYER AG (DE) 1984-10-24 EP disclosed