Tert-Butanol

Tert-Butanol

SCHEMBL28284358

CC(C)(C)O.CCCC(O)Cl.N

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL9221280 0.89
SCHEMBL13198079 0.86
SCHEMBL5719652 0.86 TSHR (0.38) TSHRLMNA
SCHEMBL1042 0.86
Chlorobutanol SCHEMBL4557423 0.85 THRB (0.48)
SCHEMBL28044604 0.83
Hydrochloric Acid SCHEMBL7323438 0.83
Water SCHEMBL5484486 0.83
Hydrochloric Acid SCHEMBL3099736 0.80
Acetic Acid SCHEMBL28401154 0.74 CHRM1 (0.46) TSHR

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
CN-106753514-B A kind of method of choline eutectic solvent abstraction desulfurization 江苏大学 2019-04-02 CN claimed
CN-106753514-B A kind of method of choline eutectic solvent abstraction desulfurization 江苏大学 2019-04-02 CN disclosed