SCHEMBL28014487

SCHEMBL28014487

CCOC(=O)OCN1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
SOAT1 P35610 1/20 0.44
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
LMNA P02545 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL28170545 0.79 KMT2A (0.54) ALDH1A1TSHRPOLBHTTLMNA
Cyclohexane SCHEMBL21644811 0.77 ALDH1A1 (0.81) ALDH1A1SOAT1TSHRLMNAHSD17B10
SCHEMBL5036796 0.76 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL21748712 0.75 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2POLBHTT
SCHEMBL29361014 0.75 ALDH1A1 (0.37) ALDH1A1TSHRPOLBHTTHSD17B10
SCHEMBL6695501 0.74 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL3673 0.74
SCHEMBL1958756 0.74 ALDH1A1 (1.00) ALDH1A1SOAT1TSHRLMNAHSD17B10
SCHEMBL1332089 0.74
SCHEMBL20382048 0.73 KMT2A (0.41) ALDH1A1TSHRPOLBLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104592164-B A kind of preparation method of ionic liquid 微宏动力系统(湖州)有限公司 2017-08-29 CN claimed
CN-104592164-A Preparation method for ionic liquid MICROVAST POWER SYSTEMS CO LTD 2015-05-06 CN claimed
CN-104592164-B A kind of preparation method of ionic liquid 微宏动力系统(湖州)有限公司 2017-08-29 CN disclosed
CN-104592164-A Preparation method for ionic liquid MICROVAST POWER SYSTEMS CO LTD 2015-05-06 CN disclosed