SCHEMBL24677053

SCHEMBL24677053

CC(C)(C)OC(=O)N1CC(c2nc(C(F)(F)F)cs2)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.40
RORC P51449 1/20 0.39
GPR119 Q8TDV5 2/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.37
HCRTR2 O43614 1/20 0.37
NAMPT P43490 1/20 0.37
STS P08842 1/20 0.37
HDAC4 P56524 3/20 0.37
HDAC6 Q9UBN7 2/20 0.37
IDH1 O75874 1/20 0.36
IDH2 P48735 1/20 0.36
USP30 Q70CQ3 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36

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
SCHEMBL9947823 0.83 HSD11B1 (0.44) NR1H2GPR119KDM4EMAPTUSP30
SCHEMBL16717787 0.82 GPR119 (0.40) NR1H2RORCGPR119KDM4EMAPT
SCHEMBL22812076 0.82 GPR119 (0.40) NR1H2RORCGPR119KDM4EMAPT
SCHEMBL18765254 0.81 GPR119 (0.39) NR1H2RORCGPR119KDM4EMAPT
SCHEMBL1118383 0.79 GPR119 (0.46) NR1H2GPR119KDM4EMAPTNAMPT
SCHEMBL18764918 0.76 NR1H2 (0.51) NR1H2GPR119MAPT
SCHEMBL24677051 0.75 LMNA (0.36) KDM4EHCRTR2IDH1
SCHEMBL4573137 0.75 CTSB (0.46) GPR119MAPTHDAC4
SCHEMBL23702818 0.75 PIK3CD (0.47) USP30
SCHEMBL23708849 0.75 PIK3CD (0.47) USP30

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
WO-2022155941-A1 CDK2 INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2022-07-28 WO disclosed