SCHEMBL30833493

SCHEMBL30833493

Cn1cc(S(=O)(=O)C(C)(F)C2CCCCN2C(=O)OC(C)(C)C)c(C(F)F)n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
WNT3 P56703 2/20 0.34
SFRP1 Q8N474 2/20 0.34
IRAK4 Q9NWZ3 3/20 0.33
NPC1 O15118 1/20 0.32
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDE8B O95263 1/20 0.31

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
SCHEMBL30833382 0.86 SFRP1 (0.38) MEN1KMT2AWNT3SFRP1NPC1
SCHEMBL17948872 0.81 STS (0.42)
SCHEMBL17948870 0.81 STS (0.42)
SCHEMBL17948869 0.81 STS (0.42)
SCHEMBL30833457 0.81 MEN1 (0.35) MEN1KMT2AWNT3SFRP1L3MBTL1
SCHEMBL30833399 0.80 MEN1 (0.38) MEN1KMT2AWNT3SFRP1NPC1
SCHEMBL30833453 0.79 WNT3 (0.38) MEN1KMT2AWNT3SFRP1NR1H2
SCHEMBL30833506 0.76 SFRP1 (0.39) MEN1KMT2AWNT3SFRP1NR1H2
SCHEMBL18025949 0.76 IRAK4 (0.35) KMT2AIRAK4
SCHEMBL17942469 0.74 KMT2A (0.34) KMT2AIRAK4

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