SCHEMBL20847474

SCHEMBL20847474

Fc1ccc(CN(Sc2c(F)c(F)c(F)c(F)c2F)C2CC2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IDO1 P14902 2/20 0.35
AGXT P21549 2/20 0.35
HTR2A P28223 6/20 0.35
RORC P51449 2/20 0.35
RIPK1 Q13546 2/20 0.35
CTSL P07711 1/20 0.34
TRPA1 O75762 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL20847791 0.97 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3KDM4ESMN1; SMN2
SCHEMBL20847761 0.82 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3KDM4ESMN1; SMN2
SCHEMBL20847500 0.81 RIPK1 (0.31) RIPK1
SCHEMBL20847502 0.79 RIPK1 (0.35) RIPK1
SCHEMBL20847720 0.79 ALDH1A1 (0.41) SLC6A2SLC6A4SLC6A3SMN1; SMN2RORC
SCHEMBL20847602 0.78 AGER (0.38) SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL20847666 0.77 SLC6A3 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL20847669 0.77 AGER (0.40) SLC6A2SLC6A4SLC6A3CTSLALDH1A1
SCHEMBL20847575 0.75 AGER (0.42) SLC6A2SLC6A4SLC6A3SMN1; SMN2ALDH1A1
SCHEMBL20847492 0.75 HDAC8 (0.37) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1

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