Isobutane

Isobutane

SCHEMBL11700646

CC(C)C.CC1CCS(=O)(=O)C1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 2/20 0.34
HTT P42858 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
SCHEMBL8344694 0.92
SCHEMBL2056459 0.92
SCHEMBL98606 0.92
Ethane SCHEMBL11704417 0.90 MAPT (0.40) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL11706411 0.87 L3MBTL1 (0.40) MAPTALDH1A1L3MBTL1HTT
Propane SCHEMBL11701165 0.85 L3MBTL1 (0.40) MAPTALDH1A1L3MBTL1SMN1; SMN2POLB
SCHEMBL27618990 0.83 MAPT (0.36) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL20819985 0.83 MAPT (0.36) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL19260974 0.80 SMN1; SMN2 (0.39) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL28306511 0.79 L3MBTL1 (0.32) ALDH1A1L3MBTL1POLB

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
US-4021490-A EXTRACTIVE DISTILLATION; SULFOLANE PHILLIPS PETROLEUM COMPANY (US) 1977-05-03 US disclosed