SCHEMBL30833454

SCHEMBL30833454

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

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
WNT3 P56703 2/20 0.35
SFRP1 Q8N474 2/20 0.35
NR1H3 Q13133 6/20 0.35
NR1H2 P55055 5/20 0.35
TRPV1 Q8NER1 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
HSD11B1 P28845 1/20 0.33
PDE8B O95263 1/20 0.33
STS P08842 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL17942467 0.81 STS (0.42) GPR119STS
SCHEMBL30833453 0.81 WNT3 (0.38) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL30833382 0.80 SFRP1 (0.38) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL30833502 0.80 MEN1 (0.42) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL30833474 0.80 KDM1A (0.39) KMT2AMEN1WNT3SFRP1TRPV1
SCHEMBL30833482 0.77 MEN1 (0.40) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL30833495 0.74 MEN1 (0.38) KMT2AMEN1NR1H3NR1H2PDE8B
SCHEMBL30833493 0.73 MEN1 (0.38) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL30833381 0.72 MEN1 (0.46) KMT2AMEN1WNT3SFRP1NR1H3
SCHEMBL17942510 0.72 KMT2A (0.36) KMT2A

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