SCHEMBL29033242

SCHEMBL29033242

CC(C)(CCCCCOCc1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.54
PPARA Q07869 4/20 0.51
LTB4R Q15722 9/20 0.50
TDP1 Q9NUW8 1/20 0.48
EPHX2 P34913 1/20 0.45

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
SCHEMBL30533275 1.00 L3MBTL1 (0.54) L3MBTL1PPARALTB4RTDP1EPHX2
SCHEMBL21677644 1.00 L3MBTL1 (0.54) L3MBTL1PPARALTB4RTDP1EPHX2
SCHEMBL10781848 1.00 L3MBTL1 (0.54) L3MBTL1PPARALTB4RTDP1EPHX2
SCHEMBL10782004 1.00 L3MBTL1 (0.54) L3MBTL1PPARALTB4RTDP1EPHX2
SCHEMBL30533272 1.00 L3MBTL1 (0.54) L3MBTL1PPARALTB4RTDP1EPHX2
SCHEMBL17746747 0.98 PPARA (0.52) L3MBTL1PPARALTB4RTDP1
SCHEMBL6714694 0.90 LTB4R (0.47) L3MBTL1PPARALTB4RTDP1
SCHEMBL10784584 0.88 L3MBTL1 (0.52) L3MBTL1LTB4RTDP1EPHX2
SCHEMBL30533289 0.88 L3MBTL1 (0.52) L3MBTL1LTB4RTDP1EPHX2
SCHEMBL30533264 0.88 L3MBTL1 (0.52) L3MBTL1LTB4RTDP1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410086-A Method for preparing isobutyric acid derivative 苏州特瑞药业股份有限公司 2023-07-11 CN disclosed