SCHEMBL14830378

SCHEMBL14830378

CC(C)(C)OC(=O)N(CC=O)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 1/20 0.51
BCL2A1 Q16548 4/20 0.39
CYP3A4 P08684 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.36
CNR2 P34972 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
DRD2 P14416 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
STS P08842 1/20 0.34

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
SCHEMBL5879096 0.85 MT-CO2 (0.40) MT-CO2CNR2STS
SCHEMBL1242387 0.85 NPC1 (0.40) MT-CO2MEN1KMT2ASMN1; SMN2
SCHEMBL1974012 0.85 MEN1 (0.46) CYP3A4MEN1KMT2AHTTSMN1; SMN2
SCHEMBL12497672 0.84 MT-CO2 (0.40) MT-CO2KMT2AHTT
SCHEMBL30358877 0.83 BCL2A1 (0.43) MT-CO2BCL2A1KMT2AGAAHTT
SCHEMBL31464829 0.83 BCL2A1 (0.43) MT-CO2BCL2A1KMT2AGAAHTT
SCHEMBL3160941 0.82 MT-CO2 (0.38) MT-CO2
SCHEMBL3657533 0.81 MT-CO2 (0.46) MT-CO2BCL2A1CYP3A4MEN1KMT2A
SCHEMBL266144 0.81 MT-CO2 (0.46) MT-CO2BCL2A1CYP3A4MEN1KMT2A
SCHEMBL14830864 0.79 MT-CO2 (0.38) MT-CO2CYP3A4GAASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760845-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2014-08-06 EP disclosed
WO-2013049250-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2013-04-04 WO disclosed