SCHEMBL2463575

SCHEMBL2463575

CC(C)C(NC(=O)c1cc(N2CCCN(C(=O)OC(C)(C)C)C(C)C2)ccc1N)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 11/20 0.42
NR1H2 P55055 11/20 0.42
HDAC1 Q13547 1/20 0.40
MAP4K4 O95819 1/20 0.38
SUV39H2 Q9H5I1 2/20 0.36
IP6K1 Q92551 1/20 0.35
HTRA1 Q92743 1/20 0.35
GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL2461843 0.85 NR1H2 (0.59) NR1H3NR1H2
SCHEMBL8198555 0.84 NR1H3 (0.40) NR1H3NR1H2HDAC1MAP4K4SUV39H2
SCHEMBL2463578 0.84 NR1H3 (0.40) NR1H3NR1H2HDAC1MAP4K4SUV39H2
SCHEMBL2458839 0.81 NR1H2 (0.41) NR1H3NR1H2HDAC1GPR119
SCHEMBL2458980 0.78 MAPT (0.41) NR1H3NR1H2HDAC1GPR119
SCHEMBL2461911 0.75 IP6K1 (0.36) HDAC1IP6K1
SCHEMBL2458971 0.74 IP6K1 (0.38) IP6K1
SCHEMBL2463468 0.74 CTSK (0.41) IP6K1
SCHEMBL2458826 0.73 SIRT6 (0.41) NR1H3NR1H2
SCHEMBL8198584 0.73 SIRT6 (0.41) NR1H3NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2069315-B1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES ORGANON NV (NL) 2011-09-07 EP disclosed
US-7820649-B2 Quinazolinone and isoquinolinone acetamide derivatives N.V. ORGANON (NL) 2010-10-26 US disclosed
EP-2069315-A2 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES N.V. Organon (NL) 2009-06-17 EP disclosed
US-20080090802-A1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES N.V. ORGANON (NL) 2008-04-17 US disclosed
WO-2008033764-A2 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES N.V. ORGANON (NL) 2008-03-20 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-20080090802-A1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES NQO2, GATD3, SDHA NR1H3 2261/4885NR1H2 1739/4885HDAC1 179/4885

“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.