Methylpyrrolidone

Methylpyrrolidone

SCHEMBL8623150

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

nearest known ligand 0.68

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.68
BRD2 P25440 1/20 0.68
LMNA P02545 2/20 0.38
KMT2A Q03164 3/20 0.37
TSHR P16473 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
INMT O95050 2/20 0.35
ALDH1A1 P00352 2/20 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 SCHEMBL180327 1.00 BRD4 (0.68) BRD4BRD2LMNAKMT2ATSHR
SCHEMBL11294331 0.92 BRD4 (0.57) BRD4BRD2LMNAKMT2AALDH1A1
Methylpyrrolidone SCHEMBL10422809 0.91 BRD4 (0.57) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL8925669 0.88 BRD4 (0.68) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL2243830 0.87 BRD4 (0.81) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL1801243 0.85 BRD4 (0.77) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL11078812 0.85 BRD4 (0.85) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL10411702 0.84 BRD4 (0.49) BRD4BRD2TSHR
Methylpyrrolidone SCHEMBL28884394 0.83 BRD4 (0.74) BRD4BRD2LMNAKMT2ATSHR
Methylpyrrolidone SCHEMBL28608007 0.83 BRD4 (0.74) BRD4BRD2LMNAKMT2ATSHR

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
EP-0607934-B1 Painting formulations for anti-adherent coatings LAMBDA SRL (IT) 1998-06-10 EP disclosed