Methylpyrrolidone

Methylpyrrolidone

SCHEMBL8469798

CN1CCCC1=O.OCC(O)CO.c1ccccc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.59
BRD2 P25440 1/20 0.59
RCE1 Q9Y256 1/20 0.40
LMNA P02545 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
PER2 O15055 2/20 0.38
PIK3CD O00329 1/20 0.37
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36

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 SCHEMBL10787779 0.95 BRD4 (0.65) BRD4BRD2RCE1LMNACA12
Methylpyrrolidone SCHEMBL1932847 0.84 BRD4 (0.65) BRD4BRD2LMNACA12CA1
Methylpyrrolidone SCHEMBL28570679 0.83 BRD4 (0.85) BRD4BRD2PIK3CDCYP2C19MEN1
Methylpyrrolidone SCHEMBL28209832 0.80 BRD4 (0.65) BRD4BRD2RCE1LMNACA12
Methylpyrrolidone SCHEMBL15441681 0.80 BRD4 (0.65) BRD4BRD2LMNACA12CA1
Methylpyrrolidone SCHEMBL3004368 0.79 BRD4 (0.77) BRD4BRD2LMNACA12CA1
Methylpyrrolidone SCHEMBL1841013 0.79 BRD4 (0.77) BRD4BRD2LMNACA12CA1
Methylpyrrolidone SCHEMBL3802011 0.79 BRD4 (0.77) BRD4BRD2LMNACA12CA1
Benzyl Alcohol SCHEMBL9464540 0.78 BRD4 (0.57) BRD4BRD2LMNAKMT2AHTT
Methylpyrrolidone SCHEMBL9815876 0.77 BRD4 (0.74) BRD4BRD2LMNACA12CA1

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
US-5922493-A LITHIUM ROCKING CHAIR TYPE BATTERY HAVING AN ABSORBER-SEPARATOR AND COMPRISING A POLYVINYLIDENE COPOLYMER MAKING UTILIZATION OF THE ACTIVE MATERIAL MORE EFFICIENT ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-07-13 US disclosed