SCHEMBL2066728

SCHEMBL2066728

CCOCc1cc(B2OC(C)(C)C(C)(C)O2)cnc1CCN

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.38
LPL P06858 6/20 0.34
LIPG Q9Y5X9 6/20 0.34
DGAT1 O75907 2/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
PDGFRB P09619 1/20 0.31
KDR P35968 1/20 0.31

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
SCHEMBL2067426 0.82 PDGFRB (0.40) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL2066726 0.79 GSK3A (0.36) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL2067111 0.77 AAK1 (0.38) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL3513769 0.74 AAK1 (0.37) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL2068827 0.73 HRH1 (0.34)
SCHEMBL2068399 0.71 AAK1 (0.40) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL24354634 0.70 LPL (0.46) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL2486269 0.70 DGAT1 (0.46) LPLLIPGDGAT1
SCHEMBL2067440 0.69 AAK1 (0.38) AAK1LPLLIPGDGAT1GSK3A
SCHEMBL2427339 0.69 GSK3A (0.39) AAK1LPLLIPGDGAT1GSK3A

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-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2014-01-02 US disclosed
US-8476294-B2 1H-imidazo[4,5-c]quinolinone derivatives NOVARTIS AG (CH) 2013-07-02 US disclosed
EP-2438063-A1 1H-IMIDAZO[4,5-C]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Novartis AG (CH) 2012-04-11 EP disclosed
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG 2010-12-16 US disclosed
WO-2010139747-A1 1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2010-12-09 WO disclosed
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 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-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS PRKCA, ABL1, MYLK2 AAK1 126/4885LPL 830/4885LIPG 430/4885
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 AAK1 136/4885LPL 739/4885LIPG 398/4885
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 AAK1 136/4885LPL 739/4885LIPG 398/4885

“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.