SCHEMBL2064796

SCHEMBL2064796

CC(=O)Oc1ccccc1C(=O)NC1CCCCn2c1nc(-c1ccncc1)cc2=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CGAS Q8N884 1/20 0.39
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.36
GSK3B P49841 6/20 0.36
CYP2C9 P11712 2/20 0.36
CNR1 P21554 1/20 0.34
CNR2 P34972 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
SCHEMBL2065962 0.91 KMT2A (0.46) CGASKMT2AALDH1A1GLAMAPT
SCHEMBL2065082 0.89 GSK3B (0.39) GSK3B
SCHEMBL2065326 0.89 KMT2A (0.46) KMT2AALDH1A1GLAMAPTMEN1
SCHEMBL2065304 0.86 GSK3B (0.40) GSK3B
SCHEMBL2064928 0.86 KDM5A (0.41) CGASKMT2AALDH1A1GLAMAPT
SCHEMBL3376845 0.86 HCRTR2 (0.46) KMT2AALDH1A1MEN1GSK3B
SCHEMBL2067036 0.84 CYP2C9 (0.40) CGASGSK3BCYP2C9
SCHEMBL2064451 0.84 HCRTR2 (0.38) CGASKMT2AALDH1A1MEN1GSK3B
SCHEMBL2065579 0.84 GSK3B (0.46) KMT2AALDH1A1GLAMAPTMEN1
SCHEMBL4952879 0.83 MEN1 (0.47) CGASKMT2AALDH1A1MEN1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148364-B2 Substituted bicyclic pyrimidone derivatives SANOFI-AVENTIS (FR) 2012-04-03 US claimed
EP-1957492-B1 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI AVENTIS (FR) 2010-11-10 EP claimed
US-20090036427-A1 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2009-02-05 US claimed
US-8148364-B2 Substituted bicyclic pyrimidone derivatives SANOFI-AVENTIS (FR) 2012-04-03 US disclosed
EP-1957492-B1 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI AVENTIS (FR) 2010-11-10 EP disclosed
US-20090036427-A1 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2009-02-05 US disclosed
EP-1957492-A2 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES sanofi-aventis (FR) 2008-08-20 EP disclosed
WO-2007057790-A2 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2007-05-24 WO 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-20090036427-A1 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES GSK3B, GSK3A, PSEN1 CGAS 2626/4885KMT2A 1782/4885ALDH1A1 1204/4885

“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.