SCHEMBL27809443

SCHEMBL27809443

CCOCC1CCCO1.OCC1CCCO1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 3/20 0.47
POLB P06746 3/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34

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
Ether SCHEMBL11356666 0.91 POLB (0.40) PDK1POLBLMNAALDH1A1SMN1; SMN2
SCHEMBL26039174 0.91
SCHEMBL1002690 0.91
SCHEMBL2909785 0.89 PDK1 (0.47) PDK1POLBLMNAALDH1A1SMN1; SMN2
SCHEMBL1838719 0.85 PDK1 (0.47) PDK1POLBLMNAALDH1A1SMN1; SMN2
Alcohol SCHEMBL7527792 0.85 LMNA (0.49) PDK1POLBLMNAALDH1A1SMN1; SMN2
2-Ethoxyethanol SCHEMBL10715490 0.84 ALDH1A1 (0.48) PDK1POLBLMNAALDH1A1SMN1; SMN2
Alcohol SCHEMBL5743324 0.82 KMT2A (0.41) PDK1POLBLMNAALDH1A1SMN1; SMN2
SCHEMBL3093708 0.81 TSHR (0.47) PDK1POLBLMNAALDH1A1SMN1; SMN2
SCHEMBL25754241 0.81 SMN1; SMN2 (0.46) PDK1POLBLMNAALDH1A1SMN1; SMN2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101805315-B Synthesis method of ethyl tetrahydrofurfuryl ether Xinjiang keyuan chemical industry co ltd 2012-11-28 CN disclosed
CN-101805314-B Synthesis method of ethyl tetrahydrofurfuryl ether XINJIANG KEYUAN CHEMICAL CO LTD 2012-10-31 CN disclosed
CN-101792425-B Synthesis method of tetrahydrofurfuryl ethyl ether XINJIANG KEYUAN CHEMICAL CO LTD 2012-08-01 CN disclosed
CN-101805315-A Synthesis method of ethyl tetrahydrofurfuryl ether YV RONG 2010-08-18 CN disclosed
CN-101805314-A Synthesis method of ethyl tetrahydrofurfuryl ether YV RONG 2010-08-18 CN disclosed
CN-101792425-A Synthesis method of tetrahydrofurfuryl ethyl ether RONG YU 2010-08-04 CN disclosed
CN-101792426-A Synthesis method of tetrahydrofurfuryl ethyl ether RONG YU 2010-08-04 CN disclosed