Tert-Butanol

Tert-Butanol

SCHEMBL3059259

CC(C)(C)O.O=C=NCCCCCCN=C=O

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.34
NAAA Q02083 1/20 0.34
GSK3B P49841 1/20 0.33
TRPA1 O75762 3/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
BACH1 O14867 1/20 0.30
MAFK O60675 1/20 0.30
EGFR P00533 1/20 0.30
PTGS2 P35354 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 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
Methyl Alcohol SCHEMBL7039090 0.87 MIF (0.39) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL11052721 0.87 NAAA (0.30) MIFNAAA
SCHEMBL4462895 0.84 MIF (0.35) MIFNAAAGSK3BFFAR1CPT2
SCHEMBL4462944 0.84 MIF (0.35) MIFNAAAGSK3BFFAR1CPT2
SCHEMBL28827914 0.84 MIF (0.35) MIFNAAAGSK3BFFAR1CPT2
SCHEMBL43799 0.84 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL8742957 0.84 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL2231808 0.84 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL10809632 0.84 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1
SCHEMBL15038 0.84 MIF (0.38) MIFNAAAGSK3BTRPA1ALDH1A1

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-8426096-B2 Capsule toner and method of manufacturing capsule toner SHARP KABUSHIKI KAISHA (JP) 2013-04-23 US disclosed
US-20100266947-A1 CAPSULE TONER AND METHOD OF MANUFACTURING CAPSULE TONER SHARP KABUSHIKI KAISHA (JP) 2010-10-21 US disclosed