Methylpyrrolidone

Methylpyrrolidone

SCHEMBL10422809

CC(=O)N(C)C.CN(C)C=O.CN1CCCC1=O

nearest known ligand 0.57

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.57
BRD2 P25440 1/20 0.57
TSHR P16473 3/20 0.40
LMNA P02545 3/20 0.33
KMT2A Q03164 5/20 0.33
MEN1 O00255 4/20 0.32
GAA P10253 4/20 0.32
MAPT P10636 4/20 0.32
ALDH1A1 P00352 3/20 0.32
PSMD14 O00487 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32

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 SCHEMBL10411702 0.93 BRD4 (0.49) BRD4BRD2TSHR
Methylpyrrolidone SCHEMBL180327 0.91 BRD4 (0.68) BRD4BRD2TSHRLMNAKMT2A
Methylpyrrolidone SCHEMBL8623150 0.91 BRD4 (0.68) BRD4BRD2TSHRLMNAKMT2A
Methylpyrrolidone SCHEMBL22765 0.89 BRD4 (0.71) BRD4BRD2TSHRLMNAKMT2A
Methylpyrrolidone SCHEMBL27412413 0.85 BRD4 (0.59) BRD4BRD2TSHRLMNAKMT2A
Methylpyrrolidone SCHEMBL28162532 0.84 BRD4 (0.50) BRD4BRD2TSHRLMNAKMT2A
SCHEMBL11294331 0.84 BRD4 (0.57) BRD4BRD2LMNAKMT2AMEN1
Methylpyrrolidone SCHEMBL28029619 0.83 BRD4 (0.57) BRD4BRD2TSHRLMNAKMT2A
Methylpyrrolidone SCHEMBL10934000 0.82 BRD4 (0.55) BRD4BRD2TSHRKMT2AMEN1
Methylpyrrolidone SCHEMBL19124976 0.81 BRD4 (0.59) BRD4BRD2TSHRLMNAKMT2A

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-4980454-A Poly(arylene cyano-thioether) copolymer and preparation thereof TOSOH CORPORATION (JP) 1990-12-25 US disclosed