SCHEMBL28636147

SCHEMBL28636147

CC(C)OC(=O)N(NC(=O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 1/20 0.49
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
TDP1 Q9NUW8 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 1/20 0.41
GAA P10253 1/20 0.41
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
TACR3 P29371 3/20 0.40
HTT P42858 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL28636145 0.89 SMN1; SMN2 (0.47) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL4241780 0.82 ALDH1A1 (0.63) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL29048566 0.78 ALDH1A1 (0.69) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL874377 0.75 TSHR (0.46) SMN1; SMN2MAPTALDH1A1TDP1L3MBTL1
SCHEMBL3507290 0.75 LMNA (0.58) SMN1; SMN2ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL28413127 0.74 CA12 (0.45) SMN1; SMN2MAPTHTTNPC1LMNA
SCHEMBL829848 0.74 TSHR (0.44) SMN1; SMN2MAPTALDH1A1TDP1L3MBTL1
SCHEMBL29025475 0.74 ALDH1A1 (0.54) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL11298089 0.72 TSHR (0.43) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL28924147 0.72 ALDH1A1 (0.51) SMN1; SMN2MAPTALDH1A1KMT2AMEN1

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-113248410-B Preparation method of silver-mediated N-aroyl hydrazine compound 湖北工业大学 2023-02-24 CN disclosed
CN-113248410-A Preparation method of silver-mediated N-arylhydrazide compound 湖北工业大学 2021-08-13 CN disclosed