SCHEMBL30833402

SCHEMBL30833402

Cc1cc(SCC2CCCCN2C(=O)OC(C)(C)C)n(C)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 1/20 0.40
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 3/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
KDM1A O60341 1/20 0.39
TSHR P16473 4/20 0.38
ATM Q13315 2/20 0.38
GAA P10253 1/20 0.38
CHEK2 O96017 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTT P42858 1/20 0.36
CPT1A P50416 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
SCHEMBL30833476 0.88 PDE8B (0.43) PDE8BALDH1A1NPSR1LMNAMAPT
SCHEMBL30833440 0.87 GAA (0.40) PDE8BALDH1A1NPSR1LMNAMAPT
SCHEMBL30833501 0.86 PDE8B (0.38) PDE8BALDH1A1NPSR1LMNAMAPT
SCHEMBL30833510 0.78 PDE8B (0.40) PDE8BALDH1A1NPSR1LMNAKDM1A
SCHEMBL29082018 0.77 ALDH1A1 (0.42) ALDH1A1NPSR1LMNAMAPTTSHR
SCHEMBL5180568 0.76 KDM1A (0.48) PDE8BALDH1A1LMNAKDM1ATSHR
SCHEMBL30833475 0.75 PDE8B (0.39) PDE8BALDH1A1NPSR1LMNAMAPT
SCHEMBL30833484 0.75 PDE8B (0.39) PDE8BALDH1A1NPSR1LMNAMAPT
SCHEMBL29423917 0.74 PDE8B (0.45) PDE8BALDH1A1KDM1ATSHRATM
SCHEMBL30833435 0.74 PDE8B (0.38) PDE8BALDH1A1NPSR1LMNAMAPT

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
CN-118164961-A 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-06-11 CN disclosed
CN-111393414-B 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-05-07 CN disclosed