SCHEMBL8914353

SCHEMBL8914353

O=[C]NOc1cccc2cccnc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
KDM4E B2RXH2 4/20 0.49
HSP90AA1 P07900 2/20 0.48
LMNA P02545 4/20 0.48
METAP2 P50579 2/20 0.48
METAP1 P53582 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
RAB9A P51151 6/20 0.46
NPC1 O15118 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 2/20 0.45
TP53 P04637 2/20 0.45
HPGD P15428 1/20 0.45
GMNN O75496 1/20 0.44
MMP2 P08253 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL28233 0.77 KDM4E (0.53) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL8914359 0.77 MAPT (0.49) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL7859708 0.75 RAB9A (0.55) MAPTKDM4ELMNARAB9ANPC1
SCHEMBL4386263 0.74 KDM4E (0.72) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL28727740 0.73 KDM4E (0.56) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL29353166 0.73 KDM4E (0.56) MAPTKDM4EHSP90AA1LMNAMETAP2
Hydrochloric Acid SCHEMBL27496748 0.72 KDM4E (0.59) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL28698652 0.72 MAPT (0.51) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL24179773 0.72 LMNA (0.55) MAPTKDM4EHSP90AA1LMNAMETAP2
SCHEMBL8008984 0.72 ALDH1A1 (0.46) KDM4ERAB9AL3MBTL1MEN1KMT2A

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
US-5633364-A N4 -substituted 2'-deoxycytidine compounds, oligonucleotides including N4 -labeled 2'-deoxycytidines, and a process for making oligonucleotides with N-modified 2'-deoxycytidines AMOCO CORPORATION (US) 1997-05-27 US claimed