Methylpyrrolidone

Methylpyrrolidone

SCHEMBL28313707

C=CF.CN1CCCC1=O

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.74
BRD2 P25440 1/20 0.74
INMT O95050 2/20 0.38
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
MAPT P10636 5/20 0.38
GAA P10253 4/20 0.38
ALDH1A1 P00352 4/20 0.38
RAB9A P51151 3/20 0.38
PSMD14 O00487 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PIK3CD O00329 1/20 0.35
LMNA P02545 3/20 0.35
IDE P14735 2/20 0.35
USP2 O75604 1/20 0.35
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33

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
Methylpyrrolidone SCHEMBL27843521 0.89 BRD4 (0.77) BRD4BRD2INMTKMT2AMEN1
Methylpyrrolidone SCHEMBL7705049 0.89 BRD4 (0.77) BRD4BRD2INMTKMT2AMEN1
Methylpyrrolidone SCHEMBL28231439 0.89
Methylpyrrolidone SCHEMBL7705903 0.86
Methylpyrrolidone SCHEMBL28121032 0.86
Methylpyrrolidone SCHEMBL8055062 0.86 BRD4 (1.00) BRD4BRD2INMTKMT2AMEN1
Methylpyrrolidone SCHEMBL5423326 0.86
Methylpyrrolidone SCHEMBL1255511 0.86 BRD4 (1.00) BRD4BRD2INMTKMT2AMEN1
Methylpyrrolidone SCHEMBL487 0.86
Methylpyrrolidone SCHEMBL28274326 0.84 BRD4 (0.85) BRD4BRD2INMTKMT2AMEN1

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-110168796-A ELECTROCHEMICAL DEVICE SEI株式会社 2019-08-23 CN disclosed