SCHEMBL20535965

SCHEMBL20535965

NC(=O)c1oc2ccc(-c3ccc(F)cc3)cc2c1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.60
HSD17B10 Q99714 7/20 0.60
ALDH1A1 P00352 7/20 0.60
HPGD P15428 6/20 0.60
MAPT P10636 6/20 0.49
TP53 P04637 2/20 0.44
TSHR P16473 1/20 0.44
AHR P35869 1/20 0.44
MAPK10 P53779 1/20 0.44
SMN1; SMN2 Q16637 6/20 0.42
HTT P42858 1/20 0.42
PGR P06401 1/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
ADORA2A P29274 1/20 0.41
CASP1 P29466 1/20 0.41
IKBKB O14920 3/20 0.40
CHUK O15111 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL1852815 0.88 KDM4E (0.67) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20534824 0.87 KDM4E (0.59) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20535044 0.87 KDM4E (0.61) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20535680 0.87 KDM4E (0.61) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20535014 0.85 KDM4E (0.78) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20535672 0.85 KDM4E (0.60) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20534820 0.85 KDM4E (0.56) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20534973 0.82 KDM4E (0.60) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20535803 0.82 KDM4E (0.62) KDM4EHSD17B10ALDH1A1HPGDMAPT
SCHEMBL20534817 0.82 KDM4E (0.56) KDM4EHSD17B10ALDH1A1HPGDMAPT

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
WO-2018189683-A1 BENZOFURAN DERIVATIVES FOR USE AS AMPK ACTIVATORS UNIVERSITA' DI PISA (IT) 2018-10-18 WO claimed
WO-2018189683-A1 BENZOFURAN DERIVATIVES FOR USE AS AMPK ACTIVATORS UNIVERSITA' DI PISA (IT) 2018-10-18 WO disclosed