SCHEMBL6851665

SCHEMBL6851665

CN(CCN(CC(N)=O)S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2)c(F)c1)S(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 13/20 0.41
FLT3 P36888 3/20 0.39
SCN9A Q15858 1/20 0.37
ROCK1 Q13464 2/20 0.36
ROCK2 O75116 1/20 0.36

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
SCHEMBL328652 0.91 P2RX7 (0.40) P2RX7FLT3SCN9AROCK1ROCK2
SCHEMBL6851659 0.87 CSF1R (0.33)
SCHEMBL6850244 0.85 EDNRA (0.39) ROCK1ROCK2
SCHEMBL328661 0.81 KMT2A (0.38)
SCHEMBL328414 0.80 DAGLA (0.37)
SCHEMBL328548 0.80 DAGLA (0.37)
SCHEMBL328658 0.79 HSP90AA1 (0.41)
SCHEMBL328654 0.79 MMP3 (0.36)
SCHEMBL328659 0.78 RORC (0.40)
SCHEMBL328544 0.77 DAGLA (0.35)

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
EP-2428509-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-03-14 EP disclosed
WO-2011011181-A1 PHARMACOLOGICAL CHAPERONES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AMICUS THERAPEUTICS, INC. (US) 2011-01-27 WO disclosed