SCHEMBL30833457

SCHEMBL30833457

Cn1nc(C(F)F)c(S(=O)(=O)C(C)(F)C2CCCCN2C(=O)OC(C)(C)C)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
STS P08842 5/20 0.33
WNT3 P56703 2/20 0.32
SFRP1 Q8N474 2/20 0.32
OPRK1 P41145 1/20 0.31
ALDH1A1 P00352 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PDE8B O95263 1/20 0.30

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
SCHEMBL30833495 0.82 MEN1 (0.38) MEN1KMT2ASTSOPRK1ALDH1A1
SCHEMBL17942421 0.82 STS (0.42) MEN1KMT2ASTSALDH1A1L3MBTL1
SCHEMBL30833455 0.81 PDE8B (0.37) MEN1KMT2ASTSOPRK1ALDH1A1
SCHEMBL30833493 0.81 MEN1 (0.38) MEN1KMT2AWNT3SFRP1ALDH1A1
SCHEMBL30833399 0.79 MEN1 (0.38) MEN1KMT2ASTSWNT3SFRP1
SCHEMBL17942487 0.75
SCHEMBL30833506 0.74 SFRP1 (0.39) MEN1KMT2ASTSWNT3SFRP1
SCHEMBL17942434 0.73 STS (0.43) STSALDH1A1L3MBTL1
SCHEMBL30833382 0.73 SFRP1 (0.38) MEN1KMT2ASTSWNT3SFRP1
SCHEMBL30833513 0.73 PDE8B (0.38) MEN1KMT2AOPRK1ALDH1A1L3MBTL1

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