SCHEMBL28744934

SCHEMBL28744934

CC(=O)OC(=O)CC(=O)c1ccc(Cl)nc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
GRM4 Q14833 4/20 0.47
RAB9A P51151 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
MAPT P10636 2/20 0.47
GAA P10253 1/20 0.46
DGAT1 O75907 2/20 0.45
POLB P06746 2/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
NPC1 O15118 1/20 0.42

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
SCHEMBL3464701 0.82 NAPRT (0.56) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL3173315 0.82 DGAT1 (0.60) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL29209494 0.81 GAA (0.51) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
Acetic Acid SCHEMBL28744937 0.80 NAPRT (0.58) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL30175321 0.79 NAPRT (0.60) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL1877325 0.79 NAPRT (0.60) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL8409678 0.77 SMN1; SMN2 (0.54) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL16166305 0.75 SMN1; SMN2 (0.52) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL1985578 0.75 NAPRT (0.64) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1
SCHEMBL6439911 0.73 NAPRT (0.62) NAPRTSMN1; SMN2GRM4RAB9AL3MBTL1

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-1257490-A Substituted pyridylpyrazoles as herbicides, insecticides and acaricides BAYER AG (DE) 2000-06-21 CN disclosed