SCHEMBL1490778

SCHEMBL1490778

Nc1nc2cnc3cccnc3c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 3/20 0.42
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 2/20 0.42
MASP2 O00187 1/20 0.42
MEN1 O00255 1/20 0.42
AOC3 Q16853 1/20 0.42
KDM4E B2RXH2 4/20 0.41
PRMT5 O14744 1/20 0.39
DYRK1A Q13627 2/20 0.39
BMPR1B O00238 1/20 0.39
PIK3C2G O75747 1/20 0.39
CDKL5 O76039 1/20 0.39
PIM1 P11309 1/20 0.39
TYK2 P29597 1/20 0.39
CLK2 P49760 1/20 0.39
STK32B Q9NY57 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
IRAK3 Q9Y616 1/20 0.39
QTRT1 Q9BXR0 1/20 0.38
CDK5 Q00535 2/20 0.36

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
SCHEMBL311312 0.80 KDM4E (0.41) ALDH1A1KMT2AMEN1KDM4EPRMT5
SCHEMBL311171 0.80 KDM4E (0.41) ALDH1A1KDM4EPRMT5DYRK1AMAPT
SCHEMBL7325665 0.79 ALDH1A1 (0.44) NUDT1ALDH1A1KMT2AMASP2MEN1
SCHEMBL88110 0.78 LMNA (0.50) NUDT1ALDH1A1KMT2AMASP2MEN1
SCHEMBL29740308 0.78 LMNA (0.50) NUDT1ALDH1A1KMT2AMASP2MEN1
SCHEMBL842050 0.77 PRMT5 (0.42) NUDT1ALDH1A1KMT2AMASP2MEN1
SCHEMBL29740307 0.77 LMNA (0.48) NUDT1ALDH1A1KMT2AMASP2MEN1
SCHEMBL2086309 0.76 KDM4E (0.39) ALDH1A1KMT2AMEN1KDM4EPRMT5
SCHEMBL202410 0.76 KDM4E (0.40) NUDT1ALDH1A1KDM4EPRMT5DYRK1A
SCHEMBL14644491 0.76 KDM4E (0.39) ALDH1A1KDM4EDYRK1AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778963-B2 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-07-15 US disclosed
US-8673932-B2 Oxime substituted imidazo-containing compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-03-18 US disclosed
US-7897767-B2 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 US disclosed
US-20090042925-A1 OXIME SUBSTITUTED IMIDAZOQUINOLINES COLEY PHARMACEUTICAL GROUP, INC. 2009-02-12 US disclosed
US-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-03 US disclosed
US-20070066639-A1 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2007-03-22 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 (3 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-20090042925-A1 OXIME SUBSTITUTED IMIDAZOQUINOLINES IFNG, IL2, IRF3 NUDT1 997/4885ALDH1A1 1493/4885KMT2A 1931/4885
US-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines IFNG, IRF3, IDO1 NUDT1 56/4885ALDH1A1 679/4885KMT2A 1578/4885
US-20070066639-A1 Oxime substituted imidazoquinolines IFNG, IRF3, IL2 NUDT1 1050/4885ALDH1A1 1370/4885KMT2A 2150/4885

“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.