SCHEMBL17560993

SCHEMBL17560993

O=C(NN=Cc1cccc(C(F)(F)F)c1)NN=Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.74
KDM4E B2RXH2 4/20 0.69
KMT2A Q03164 7/20 0.67
MAPT P10636 7/20 0.67
MEN1 O00255 5/20 0.67
HTT P42858 3/20 0.67
GFER P55789 1/20 0.62
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
GALR3 O60755 1/20 0.56
XBP1 P17861 1/20 0.56
MAPK1 P28482 1/20 0.56
LMNA P02545 2/20 0.54
GAA P10253 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
POLB P06746 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
ALPL P05186 1/20 0.51
ALPI P09923 1/20 0.51

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
SCHEMBL17574201 1.00 RECQL (0.74) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19434691 0.91 RECQL (0.71) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL17067806 0.91 RECQL (0.67) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19434693 0.91 RECQL (0.71) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19441401 0.90 RECQL (0.66) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19449614 0.88 RECQL (0.80) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL31043533 0.88 RECQL (0.80) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL17560900 0.88 RECQL (0.80) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19441400 0.88 RECQL (0.63) RECQLKDM4EKMT2AMAPTMEN1
SCHEMBL19449680 0.84 RECQL (0.66) RECQLKDM4EKMT2AMAPTMEN1

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-3188722-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS Neoculi Pty Ltd (AU) 2017-07-12 EP claimed
WO-2016033635-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2016-03-10 WO claimed