Isobutane

Isobutane

SCHEMBL4523728

CC(C)C.CC(C)C.CCCC(C)(C)C(C)(O)O

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
FDPS P14324 1/20 0.33

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
SCHEMBL93676 0.91 ALDH1A1 (0.39) ALDH1A1FDPS
Propylene Glycol SCHEMBL9343111 0.85 TDP1 (0.46)
SCHEMBL201294 0.84 CHRM1 (0.34) ALDH1A1FDPS
SCHEMBL393486 0.84 CHRM1 (0.34) ALDH1A1FDPS
SCHEMBL10923385 0.79 FDPS (0.31) ALDH1A1FDPS
SCHEMBL20218 0.74 FDPS (0.36) ALDH1A1FDPS
Butyric Acid SCHEMBL28570191 0.74 FFAR3 (0.56) ALDH1A1
SCHEMBL23467084 0.73 ALDH1A1 (0.39) ALDH1A1FDPS
SCHEMBL10486986 0.73 ALDH1A1 (0.39) ALDH1A1FDPS
SCHEMBL10894040 0.72 FDPS (0.34) ALDH1A1FDPS

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
US-8202832-B2 Nano-clay composite and composition for fabricating the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-06-19 US disclosed
US-20090105112-A1 Nono-clay composite and composition for fabricating the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-04-23 US disclosed