SCHEMBL7963233

SCHEMBL7963233

CCOc1cccc(/C=N/Nc2nccnc2OC)c1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.64
KDM4E B2RXH2 6/20 0.64
MAPT P10636 6/20 0.64
L3MBTL1 Q9Y468 4/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
TDP1 Q9NUW8 3/20 0.64
KLF5 Q13887 3/20 0.64
PKM P14618 2/20 0.64
NFKB1 P19838 1/20 0.64
NFKB2 Q00653 1/20 0.64
RELA Q04206 1/20 0.64
NCOA3 Q9Y6Q9 1/20 0.53
RAB9A P51151 5/20 0.51
LMNA P02545 3/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
GAA P10253 3/20 0.50
ALDH1A1 P00352 1/20 0.50
HSP90AA1 P07900 1/20 0.48
ALPL P05186 1/20 0.48

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
SCHEMBL7963239 1.00 HTT (0.64) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7951018 0.84 KDM4E (0.60) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7951013 0.84 KDM4E (0.60) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7965463 0.82 MAPT (0.58) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7965465 0.82 MAPT (0.58) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7963300 0.79 KMT2A (0.65) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7963295 0.79 KMT2A (0.65) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7960927 0.78 MAPT (0.52) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7960932 0.78 MAPT (0.52) HTTKDM4EMAPTL3MBTL1SMN1; SMN2
SCHEMBL7963341 0.78 MAPT (0.60) HTTKDM4EMAPTL3MBTL1SMN1; SMN2

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
US-6329378-B1 HETEROCYCLIC FUNGICIDES AND ANTIGROWTH AGENTS ANADYS PHARMACEUTICALS, INC. 2001-12-11 US claimed
US-6329378-B1 HETEROCYCLIC FUNGICIDES AND ANTIGROWTH AGENTS ANADYS PHARMACEUTICALS, INC. 2001-12-11 US disclosed