SCHEMBL30833452

SCHEMBL30833452

O=S(=O)(c1cccc(F)c1)C(F)(F)C1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.47
HTR2B P41595 1/20 0.47
HTR6 P50406 17/20 0.46
WNT3 P56703 1/20 0.39
SFRP1 Q8N474 1/20 0.39

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
SCHEMBL17942386 1.00 HTR2C (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL17942305 0.87 HTR6 (0.50) HTR2CHTR2BHTR6
SCHEMBL17949307 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL30833392 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL17948971 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL30833472 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL30833407 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL17949306 0.86 HTR6 (0.47) HTR2CHTR2BHTR6WNT3SFRP1
SCHEMBL17942395 0.78 CYP3A4 (0.48) HTR2C
SCHEMBL22585222 0.77 F10 (0.40)

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