SCHEMBL20847775

SCHEMBL20847775

O=C(O)c1ccc(CN(Sc2c(F)c(F)c(F)c(F)c2F)C2CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
HDAC8 Q9BY41 6/20 0.43
HDAC6 Q9UBN7 6/20 0.43
HDAC11 Q96DB2 2/20 0.42
HDAC3 O15379 1/20 0.42
TAS2R14 Q9NYV8 3/20 0.39
LPAR1 Q92633 4/20 0.38
LPAR5 Q9H1C0 4/20 0.38
NSD2 O96028 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALDH2 P05091 1/20 0.38
MEP1B Q16820 1/20 0.38
AGER Q15109 2/20 0.37
MTNR1A P48039 1/20 0.37

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
SCHEMBL20847480 0.88 HDAC6 (0.43) HDAC8HDAC6HDAC11HDAC3NSD2
SCHEMBL24473070 0.86 HDAC6 (0.61) HDAC8HDAC6HDAC11HDAC3
SCHEMBL20847600 0.85 HDAC8 (0.43) KMT2AMEN1HDAC8HDAC6HDAC11
SCHEMBL20847664 0.83 ESR1 (0.38) HDAC8HDAC6HDAC11HDAC3NSD2
SCHEMBL20847785 0.82 LMNA (0.47) KMT2AMEN1ALDH1A1AGERMTNR1A
SCHEMBL20847506 0.80 EPHX1 (0.43) KMT2AMEN1HDAC8HDAC6HDAC11
SCHEMBL20847604 0.80 SLC6A2 (0.38) HDAC8HDAC6HDAC11HDAC3AGER
SCHEMBL20847477 0.79 SLC6A2 (0.39) HDAC8HDAC6HDAC11HDAC3ALDH1A1
SCHEMBL20847602 0.79 AGER (0.38) KMT2AMEN1HDAC8HDAC6HDAC3
SCHEMBL20847642 0.78 SLC6A4 (0.35) KMT2AMEN1HDAC8HDAC6ALDH1A1

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