SCHEMBL20847720

SCHEMBL20847720

Fc1ccccc1CN(Sc1c(F)c(F)c(F)c(F)c1F)C1CCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.41
SLC6A2 P23975 4/20 0.40
SLC6A3 Q01959 3/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PKM P14618 2/20 0.36
SLC6A4 P31645 2/20 0.34
MAPT P10636 1/20 0.34
RORC P51449 1/20 0.33
NR1H3 Q13133 1/20 0.33
RORB Q92753 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
OPRM1 P35372 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
SCHEMBL20847761 0.97 SLC6A2 (0.40) ALDH1A1SLC6A2SLC6A3KMT2AMEN1
SCHEMBL20847791 0.82 SLC6A2 (0.42) ALDH1A1SLC6A2SLC6A3SMN1; SMN2SLC6A4
SCHEMBL20847474 0.79 SLC6A2 (0.42) ALDH1A1SLC6A2SLC6A3SMN1; SMN2SLC6A4
SCHEMBL20847602 0.77 AGER (0.38) ALDH1A1SLC6A2SLC6A3KMT2AMEN1
SCHEMBL20847502 0.76 RIPK1 (0.35)
SCHEMBL20847669 0.76 AGER (0.40) ALDH1A1SLC6A2SLC6A3KMT2AMEN1
SCHEMBL20847575 0.75 AGER (0.42) ALDH1A1SLC6A2SLC6A3KMT2AMEN1
SCHEMBL20847704 0.72 RAB9A (0.46) SLC6A2SLC6A3KMT2ASMN1; SMN2SLC6A4
SCHEMBL20847500 0.71 RIPK1 (0.31)
SCHEMBL20847654 0.71 ALDH1A1 (0.38) ALDH1A1SLC6A2SLC6A3KMT2AMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019056120-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF DALRIADA THERAPEUTICS INC. (CA) 2019-03-28 WO disclosed