SCHEMBL793001

SCHEMBL793001

COC(=O)OC1CC(=O)N(C)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 9/20 0.54
CYP1A2 P05177 1/20 0.37
HIF1A Q16665 1/20 0.37
PDE4A P27815 3/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
P2RX7 Q99572 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
SCHEMBL18472043 0.81 BRD4 (0.49) BRD4MEN1KMT2A
SCHEMBL17294389 0.81 BRD4 (0.49) BRD4MEN1KMT2A
SCHEMBL21026694 0.81 BRD4 (0.49) BRD4MEN1KMT2A
SCHEMBL688823 0.81 BRD4 (0.49) BRD4PDE4APDE4BPDE4CPDE4D
SCHEMBL14856811 0.81 BRD4 (0.49) BRD4PDE4APDE4BPDE4CPDE4D
SCHEMBL793587 0.81 MEN1 (0.46) BRD4SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL20665982 0.81 BRD4 (0.45) BRD4CYP1A2PDE4APDE4BPDE4C
SCHEMBL18014917 0.80 BRD4 (0.49) BRD4PDE4APDE4BPDE4CPDE4D
SCHEMBL21872654 0.80 BRD4 (0.47) BRD4PDE4APDE4BPDE4CPDE4D
SCHEMBL4464249 0.77 BRD4 (0.45) BRD4SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616438-A1 USE OF N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS AS SOLVENTS Clariant Finance (BV) Limited (VG) 2013-07-24 EP disclosed
EP-2615911-A1 PESTICIDE PREPARATIONS CONTAINING N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS Clariant Finance (BVI) Limited (VG) 2013-07-24 EP disclosed
WO-2012034689-A1 PESTICIDE PREPARATIONS CONTAINING N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS CLARIANT INTERNATIONAL LTD (CH) 2012-03-22 WO disclosed
WO-2012034688-A1 USE OF N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS AS SOLVENTS CLARIANT INTERNATIONAL LTD (CH) 2012-03-22 WO disclosed