SCHEMBL30833456

SCHEMBL30833456

Cn1nc(C(F)F)cc1S(=O)(=O)C(C)(F)C1CCCCN1C(=O)Nc1ccnnc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.35
EPHX2 P34913 2/20 0.34
MAPT P10636 1/20 0.32
WNT3 P56703 1/20 0.32
SFRP1 Q8N474 1/20 0.32
ALDH1A1 P00352 2/20 0.32
SCN10A Q9Y5Y9 3/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30
TRPV1 Q8NER1 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
SCHEMBL30833427 0.89 RORC (0.36) RORCEPHX2MAPTWNT3SFRP1
SCHEMBL17949310 0.84 SPR (0.36) RORCEPHX2SCN10ALMNATRPV1
SCHEMBL30833437 0.82 RORC (0.37) RORCEPHX2MAPTWNT3SFRP1
SCHEMBL30833421 0.80 RORC (0.36) RORCEPHX2MAPTWNT3SFRP1
SCHEMBL17948928 0.80 LMNA (0.35) RORCEPHX2ALDH1A1TSHRLMNA
SCHEMBL19996409 0.79 SPR (0.35) RORCEPHX2SCN10ALMNATRPV1
SCHEMBL30833399 0.79 MEN1 (0.38) WNT3SFRP1ALDH1A1LMNATRPV1
SCHEMBL30833432 0.77 EPHX2 (0.37) RORCEPHX2WNT3SFRP1ALDH1A1
SCHEMBL30833471 0.76 RORC (0.36) RORCEPHX2MAPTWNT3SFRP1
Trifluoroacetic Acid SCHEMBL30833404 0.76 RORC (0.40) RORCEPHX2MAPTWNT3SFRP1

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