SCHEMBL15436196

SCHEMBL15436196

Cn1nc(-c2ccc(O)c(O)c2)cc1-c1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 7/20 0.47
MAPT P10636 3/20 0.43
ALOX15 P16050 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HSP90AA1 P07900 1/20 0.43
HPGD P15428 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
APP P05067 1/20 0.41
ESR2 Q92731 1/20 0.41
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL5597719 0.86 ESR2 (0.54) FYNMAPTHPGDPSEN1PSEN2
SCHEMBL14458205 0.83 MAPT (0.46) MAPTSMN1; SMN2NPSR1HPGDPSEN1
SCHEMBL5598135 0.78 STAT3 (0.47) FYNMAPTSMN1; SMN2HPGDPSEN1
SCHEMBL25645955 0.78 ESR2 (0.44) FYNMAPTALOX15SMN1; SMN2NPSR1
SCHEMBL5597739 0.76 BACE1 (0.46) FYNMAPTSMN1; SMN2NPSR1HPGD
SCHEMBL16804440 0.73 MEN1 (0.50) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL16344869 0.72 IDO1 (0.42) FYNMAPTNPSR1HPGDMEN1
SCHEMBL17372934 0.72 MAPT (0.53) MAPTSMN1; SMN2NPSR1HPGDMEN1
SCHEMBL5385380 0.72 GABRG2 (0.51)
SCHEMBL17279861 0.71 KMT2A (0.47) MAPTNPC1RAB9AKMT2ALMNA

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
EP-2687513-A1 Drugs for inhibiting aggregation of proteins invoved in diseases linked to protein aggregation and/or neurodegenerative diseases Ludwig-Maximilians-Universität München (DE) 2014-01-22 EP disclosed