SCHEMBL28964893

SCHEMBL28964893

C=C(NC(=O)OCC)C(=O)OC1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.40
NAAA Q02083 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
THRB P10828 1/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 3/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
POLB P06746 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL1999691 0.79 EPHX1 (0.47) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL11690213 0.78 EPHX1 (0.51) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL7034602 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL6541881 0.77 EPHX1 (0.52) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL9292325 0.76 EPHX1 (0.45) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL8928249 0.76 ALDH1A1 (0.45) SMN1; SMN2L3MBTL1ALDH1A1TRPM8NPSR1
SCHEMBL317579 0.76 NAAA (0.47) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
Ethyl Acetate SCHEMBL28105314 0.75 ALDH1A1 (0.45) EPHX1SMN1; SMN2NAAAL3MBTL1THRB
SCHEMBL4650635 0.75 ALDH1A1 (0.39) L3MBTL1THRBALDH1A1LMNAKDM4E
SCHEMBL528947 0.74 NAAA (0.46) EPHX1SMN1; SMN2NAAAL3MBTL1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117020164-A Preparation method of mobile phone data line shell 东莞市凯晟鑫五金电子有限公司 2023-11-10 CN claimed
CN-115537128-B High-elasticity sealing adhesive for USB Type-C connector and preparation method thereof 惠州市杜科新材料有限公司 2023-10-20 CN claimed
CN-117020164-A Preparation method of mobile phone data line shell 东莞市凯晟鑫五金电子有限公司 2023-11-10 CN disclosed
CN-115537128-B High-elasticity sealing adhesive for USB Type-C connector and preparation method thereof 惠州市杜科新材料有限公司 2023-10-20 CN disclosed
CN-115537128-A High-elasticity sealing adhesive for USB Type-C connector and preparation method thereof 惠州市杜科新材料有限公司 2022-12-30 CN disclosed