SCHEMBL30833484

SCHEMBL30833484

Cn1cc(SCC2CCCCN2C(=O)OC(C)(C)C)c(C(F)(F)F)n1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM1A O60341 1/20 0.37
ATM Q13315 2/20 0.36
TSHR P16473 4/20 0.36
F2RL3 Q96RI0 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
CHEK2 O96017 1/20 0.35
LMNA P02545 2/20 0.35
TRPV1 Q8NER1 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
SCHEMBL30833435 0.85 PDE8B (0.38) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833475 0.84 PDE8B (0.39) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833474 0.80 KDM1A (0.39) PDE8BALDH1A1KDM1AATMMEN1
SCHEMBL30833440 0.78 GAA (0.40) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833439 0.76 KDM1A (0.44) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833402 0.75 PDE8B (0.40) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833453 0.74 WNT3 (0.38) ALDH1A1TSHRMEN1KMT2AMAPT
SCHEMBL5180568 0.73 KDM1A (0.48) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833476 0.73 PDE8B (0.43) PDE8BALDH1A1KDM1AATMTSHR
SCHEMBL30833382 0.73 SFRP1 (0.38) MEN1KMT2A

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