SCHEMBL30833483

SCHEMBL30833483

CC(C)(C)OC(=O)N1CCCCC1C1(S(=O)(=O)c2cccc(F)c2)CC(F)(F)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.42
NR1H3 Q13133 7/20 0.42
NR1H2 P55055 7/20 0.42
APP P05067 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
DRD2 P14416 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
SLC6A2 P23975 1/20 0.40
HRH2 P25021 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR7 P34969 1/20 0.40
DRD3 P35462 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 1/20 0.40
PSEN1 P49768 1/20 0.40

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
SCHEMBL30833466 0.89 RIPK1 (0.42) RIPK1NR1H3NR1H2APPHTR1A
SCHEMBL30833417 0.89 RIPK1 (0.42) RIPK1NR1H3NR1H2APPHTR1A
SCHEMBL17949133 0.83 GPR119 (0.48) GPR119
SCHEMBL29529583 0.83 GPR119 (0.48) GPR119
SCHEMBL30833481 0.80 NR1H3 (0.48) RIPK1NR1H3NR1H2MEN1KMT2A
SCHEMBL30833419 0.79 RIPK1 (0.47) RIPK1NR1H3NR1H2APPHTR1A
SCHEMBL30833395 0.77 APP (0.46) RIPK1NR1H3NR1H2APPHTR1A
SCHEMBL30833477 0.77 RORC (0.44) MEN1KMT2ARORC
SCHEMBL30833386 0.77 RIPK1 (0.45) RIPK1NR1H3NR1H2APPHTR1A
SCHEMBL30833425 0.77 RIPK1 (0.45) RIPK1NR1H3NR1H2APPHTR1A

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