Butoxyethanol

Butoxyethanol

SCHEMBL14157136

CC(=O)OCCOC(C)=O.CCCCOCCO.OCCO

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.65
ALDH1A1 P00352 5/20 0.63
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
THRB P10828 1/20 0.53
HTT P42858 1/20 0.53
MAPT P10636 1/20 0.53
ACHE P22303 1/20 0.42
CES2 O00748 1/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 2/20 0.41
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
CASP1 P29466 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
ATM Q13315 1/20 0.39
EPHX2 P34913 1/20 0.39
DGKA P23743 1/20 0.38

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
SCHEMBL1401440 0.96 TSHR (0.65) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL7777622 0.96 TSHR (0.65) TSHRALDH1A1MEN1KMT2ATHRB
Di(Hydroxyethyl)Ether SCHEMBL13516981 0.96 TSHR (0.65) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL273114 0.96 TSHR (0.65) TSHRALDH1A1MEN1KMT2ATHRB
Ethylene Glycol SCHEMBL10904075 0.94 ALDH1A1 (0.65) TSHRALDH1A1MEN1KMT2ATHRB
Acetic Acid Butyl Ester SCHEMBL1181041 0.94 ALDH1A1 (0.72) TSHRALDH1A1MEN1KMT2ATHRB
Acetic Acid Butyl Ester SCHEMBL3052242 0.92 ALDH1A1 (0.69) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL15136261 0.92 TSHR (0.65) TSHRALDH1A1MEN1KMT2ATHRB
Acetic Acid Butyl Ester SCHEMBL974001 0.92 ALDH1A1 (0.75) TSHRALDH1A1MEN1KMT2ATHRB
SCHEMBL5498331 0.92 ALDH1A1 (0.68) TSHRALDH1A1MEN1KMT2ATHRB

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
EP-2718389-A1 MODIFIED NONIONIC SURFACTANT FORMULATIONS FOR ENHANCED OIL RECOVERY Dow Global Technologies LLC (US) 2014-04-16 EP disclosed
WO-2012170835-A1 MODIFIED NONIONIC SURFACTANT FORMULATIONS FOR ENHANCED OIL RECOVERY DOW GLOBAL TECHNOLOGIES LLC (US) 2012-12-13 WO disclosed