SCHEMBL6284484

SCHEMBL6284484

Nc1cnc2cccnc2c1NCCCCNC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.44
HDAC6 Q9UBN7 2/20 0.44
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
HDAC3 O15379 3/20 0.35
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADORA2B P29275 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
ASPH Q12797 1/20 0.34
KDM8 Q8N371 1/20 0.34
RPS6KB1 P23443 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
TOP2A P11388 1/20 0.34

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
SCHEMBL5510128 0.93 HDAC1 (0.36) HDAC1HDAC6TLR8TLR7ADORA2A
SCHEMBL27666669 0.87 HTT (0.42) HDAC1HDAC6MEN1ALDH1A1TP53
SCHEMBL5617080 0.87 HTT (0.42) HDAC1HDAC6MEN1ALDH1A1TP53
SCHEMBL3352911 0.83 KDM4E (0.46) HDAC1HDAC6ADORA2AADORA1BCHE
SCHEMBL1950078 0.82 POLB (0.46) MEN1ALDH1A1KMT2ATOP2ABCHE
SCHEMBL6281042 0.81 LMNA (0.42) HDAC1HDAC6MEN1ALDH1A1KMT2A
SCHEMBL6281044 0.81 LMNA (0.42) HDAC1HDAC6MEN1ALDH1A1KMT2A
SCHEMBL1233374 0.81 KDM4E (0.46) ADORA2AADORA1ADORA2BBCHE
SCHEMBL5617083 0.81 TOP2A (0.51) HDAC1HDAC6TLR8TLR7MEN1
SCHEMBL27670113 0.81 TLR8 (0.36) HDAC1HDAC6TLR8TLR7MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6894165-B2 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-17 US disclosed
US-20040204436-A1 Imidazonaphthyridines MEDICIS PHARMACEUTICAL CORPORATION 2004-10-14 US disclosed
US-6699878-B2 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-03-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040204436-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 HDAC1 1650/4885HDAC6 1469/4885TLR8 186/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.