SCHEMBL29262256

SCHEMBL29262256

N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)C(F)(F)C1CCCCN1C(=O)Nc1ccnnc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.38
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
AR P10275 8/20 0.35
TRPV1 Q8NER1 1/20 0.34
DPP4 P27487 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
LRRK2 Q5S007 1/20 0.34
WNT3 P56703 1/20 0.33
SFRP1 Q8N474 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
SCHEMBL17942515 0.84 TRPV1 (0.41) RORCHTR2AHTR2CTRPV1LRRK2
SCHEMBL30833471 0.78 RORC (0.36) RORCTRPV1LRRK2WNT3SFRP1
SCHEMBL30833492 0.77 RORC (0.36) RORCTRPV1TRPM8LRRK2WNT3
SCHEMBL30833449 0.76 RORC (0.42) RORCWNT3SFRP1
SCHEMBL30833394 0.75 RORC (0.35) RORCTRPV1LRRK2WNT3SFRP1
SCHEMBL30833437 0.75 RORC (0.37) RORCTRPV1SCN10AWNT3SFRP1
SCHEMBL30833421 0.74 RORC (0.36) RORCSCN10ALRRK2WNT3SFRP1
SCHEMBL17948885 0.72 TRPV1 (0.47) RORCTRPV1
SCHEMBL17949343 0.72 CA12 (0.39) TRPV1
SCHEMBL29529392 0.72 CA12 (0.39) TRPV1

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