SCHEMBL29558262

SCHEMBL29558262

[2H]C([2H])(C1CCN(C(=O)OC(C)(C)C)CC1)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
PKM P14618 1/20 0.54
GPR119 Q8TDV5 7/20 0.50
BRD4 O60885 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
ACHE P22303 1/20 0.46
TP53 P04637 1/20 0.46
STS P08842 1/20 0.46
TGFBR1 P36897 1/20 0.45

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
SCHEMBL27038680 1.00 KDM4E (0.54) KDM4EPKMGPR119BRD4L3MBTL1
SCHEMBL12635860 0.88 KDM4E (0.56) KDM4EPKMGPR119BRD4L3MBTL1
SCHEMBL30288086 0.87 GPR119 (0.52) KDM4EPKMGPR119ACHE
SCHEMBL8825578 0.87 ACHE (0.64) KDM4EPKMGPR119BRD4L3MBTL1
SCHEMBL29890980 0.87 ACHE (0.64) KDM4EPKMGPR119BRD4L3MBTL1
SCHEMBL6953531 0.86 ACHE (0.55) KDM4EPKMGPR119ACHE
SCHEMBL5475624 0.84 ACHE (0.53) KDM4EPKMGPR119ACHE
SCHEMBL31596884 0.83 GPR119 (0.53) KDM4EPKMGPR119ACHE
SCHEMBL23884184 0.82 ACHE (0.51) KDM4EPKMGPR119BRD4L3MBTL1
SCHEMBL22849388 0.81 GPR119 (0.57) KDM4EPKMGPR119BRD4L3MBTL1

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-4240352-A1 T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF Praxis Precision Medicines, Inc. (US) 2023-09-13 EP disclosed
WO-2022099207-A1 T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2022-05-12 WO disclosed