SCHEMBL28946337

SCHEMBL28946337

CCOC(=O)C(Cl)CCC=NNC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 2/20 0.34
CYP1A2 P05177 2/20 0.32
GAA P10253 3/20 0.32
MMP8 P22894 2/20 0.32
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MIF P14174 1/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL28855702 0.74 MAPT (0.42) ALDH1A1SMN1; SMN2L3MBTL1LMNAGAA
SCHEMBL2868181 0.73 ALDH1A1 (0.46) ALDH1A1L3MBTL1LMNAGAAMMP8
SCHEMBL27856197 0.73 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2L3MBTL1LMNAGAA
SCHEMBL5541260 0.71 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL15534741 0.71 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL15534740 0.71 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL8149342 0.69 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNAGAAMMP8
SCHEMBL2858639 0.69 CPB2 (0.43) ALDH1A1L3MBTL1LMNACYP1A2GAA
SCHEMBL6755582 0.69 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNACYP1A2GAA
SCHEMBL27631184 0.69 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNAGAAMMP8

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-114790176-A Imidazole compound and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-07-26 CN disclosed