SCHEMBL30833504

SCHEMBL30833504

CC(C)(C)OC(=O)N1CCCCC1C(F)(F)S(=O)(=O)c1cccnc1N

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.40
POLB P06746 3/20 0.39
WNT3 P56703 2/20 0.39
SFRP1 Q8N474 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 1/20 0.37
UCHL1 P09936 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE8B O95263 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35

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
SCHEMBL30833385 0.88 POLB (0.45) GPR119POLBWNT3SFRP1KDM4E
SCHEMBL30833512 0.82 WNT3 (0.36) GPR119POLBWNT3SFRP1KDM4E
SCHEMBL30833463 0.81 MEN1 (0.43) GPR119WNT3SFRP1NR1H2NR1H3
SCHEMBL17942411 0.81 GPR119 (0.52) GPR119POLB
SCHEMBL29529620 0.81 GPR119 (0.52) GPR119POLB
SCHEMBL30833487 0.80 SFRP1 (0.40) GPR119POLBWNT3SFRP1KDM4E
SCHEMBL30833425 0.78 RIPK1 (0.45) GPR119POLBWNT3SFRP1NR1H2
SCHEMBL28527698 0.74 POLB (0.44) GPR119POLBKDM4EUCHL1MEN1
SCHEMBL30833508 0.73 WNT3 (0.36) WNT3SFRP1NR1H2NR1H3MEN1
SCHEMBL17942533 0.73 SFRP1 (0.38) GPR119SFRP1KDM4E

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