SCHEMBL28381920

SCHEMBL28381920

CCOC(=O)C(C)c1nc(N)c(C)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
ALDH1A1 P00352 8/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 2/20 0.39
FHIT P49789 1/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 2/20 0.39
ABCB1 P08183 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
CDC7 O00311 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
MEN1 O00255 1/20 0.36
L3MBTL1 Q9Y468 2/20 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
SCHEMBL10735138 0.75 POLB (0.54) LMNAALDH1A1CYP1A2POLBFHIT
SCHEMBL16636292 0.74 ALDH1A1 (0.46) LMNAALDH1A1CYP1A2POLBFHIT
SCHEMBL16797612 0.71 LMNA (0.44) LMNAALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL634161 0.69 ESR2 (0.40) LMNAALDH1A1CYP1A2POLBHPGD
SCHEMBL999516 0.68 ALDH1A1 (0.56) ALDH1A1CYP1A2POLBHPGDMAPT
SCHEMBL28979284 0.66 GAA (0.52) LMNAALDH1A1CYP1A2POLBFHIT
SCHEMBL11588493 0.66 MAPT (0.40) LMNAALDH1A1CYP1A2POLBHPGD
SCHEMBL908619 0.66 ALDH1A1 (0.49) LMNAALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL19028033 0.65 TSHR (0.37) LMNAALDH1A1POLBHPGDMAPT
SCHEMBL16746890 0.65 ALOX5 (0.46) LMNAALDH1A1CYP1A2HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111116509-A Method for recycling waste water from ethyl demethylaminothiazolyloximate production 山东鑫泉医药有限公司 2020-05-08 CN disclosed
CN-106699681-B Synthetic method of ethyl noraminothiazolyloximate 淄博鑫泉医药技术服务有限公司 2020-03-20 CN disclosed