Butane

Butane

SCHEMBL8559403

C1CO1.C1CO1.CCCC

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.46
TSHR P16473 3/20 0.33
LMNA P02545 2/20 0.31
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTT P42858 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
Butane SCHEMBL9314114 1.00
Dioxane SCHEMBL20141462 0.95 TTR (0.55) TTRTSHRLMNAPOLBSMN1; SMN2
Butane SCHEMBL28165623 0.95
Butane SCHEMBL28329516 0.86
Oxirane SCHEMBL2842413 0.84
Dioxane SCHEMBL6826845 0.82 TSHR (0.58) TTRTSHRLMNAPOLBSMN1; SMN2
Pentane SCHEMBL27681570 0.82
Hexane SCHEMBL5207457 0.82
Oxirane SCHEMBL27733054 0.80
Tetrahydrofuran SCHEMBL6854578 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0595458-B1 Novel thiomarinol derivatives, and processes for their preparation SANKYO CO (JP) 1998-11-25 EP claimed
EP-0595458-A1 Novel thiomarinol derivatives, and processes for their preparation SANKYO COMPANY LIMITED (JP) 1994-05-04 EP claimed
US-8796474-B1 Macrolide compounds and methods and intermediates useful for their preparation RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-08-05 US disclosed
EP-0595458-B1 Novel thiomarinol derivatives, and processes for their preparation SANKYO CO (JP) 1998-11-25 EP disclosed
US-5399711-A Bactericides, antimycoplasma agent, from Alteromonas SANKYO COMPANY, LIMITED (JP) 1995-03-21 US disclosed
EP-0595458-A1 Novel thiomarinol derivatives, and processes for their preparation SANKYO COMPANY LIMITED (JP) 1994-05-04 EP disclosed