SCHEMBL20847704

SCHEMBL20847704

Fc1c(F)c(F)c(SN(Cc2ccccn2)C2CC2)c(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
TSHR P16473 2/20 0.43
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LIN28A Q9H9Z2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KCNA5 P22460 2/20 0.36
SLC6A2 P23975 4/20 0.36
SLC6A4 P31645 4/20 0.36
SLC6A3 Q01959 4/20 0.36
KMT2A Q03164 1/20 0.35
CYP2D6 P10635 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CHRNA7 P36544 1/20 0.34

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
SCHEMBL20847629 0.81 HTR2A (0.34)
SCHEMBL20847643 0.76 CXCR4 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL20847594 0.76 STAT3 (0.38) SMN1; SMN2TDP1KMT2A
SCHEMBL20847650 0.75 ALDH1A1 (0.35) CYP2D6
SCHEMBL20847761 0.75 SLC6A2 (0.40) MAPTSMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL20847720 0.72 ALDH1A1 (0.41) MAPTSMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL20847666 0.70 SLC6A3 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL20847664 0.70 ESR1 (0.38)
SCHEMBL20847604 0.70 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL22593297 0.69 SMN1; SMN2 (0.52) RAB9ATSHRMAPTSMN1; SMN2LIN28A

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