SCHEMBL2067564

SCHEMBL2067564

CCNc1ncc(B2OC(C)(C)C(C)(C)O2)c(OC)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 11/20 0.34
CYP2C19 P33261 5/20 0.34
ALDH1A1 P00352 12/20 0.33
HSD17B10 Q99714 11/20 0.33
CASP1 P29466 8/20 0.33
CASP7 P55210 8/20 0.33
CYP3A4 P08684 8/20 0.33
CLK4 Q9HAZ1 6/20 0.33
MEN1 O00255 6/20 0.33
KMT2A Q03164 6/20 0.33
GLA P06280 5/20 0.33
UCHL1 P09936 1/20 0.33
ALOX15 P16050 1/20 0.33
USP2 O75604 8/20 0.33
TSHR P16473 6/20 0.33
HIF1A Q16665 5/20 0.33
CYP2C9 P11712 4/20 0.33
MAPK1 P28482 3/20 0.33
TP53 P04637 2/20 0.33
ALPL P05186 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
SCHEMBL15961459 0.86 BCL6 (0.36) ALDH1A1MEN1KMT2AUCHL1MAPK1
SCHEMBL2066865 0.85 ALPL (0.34) UCHL1ALPLDGAT1
SCHEMBL7876938 0.83 BCL6 (0.32) CYP1A2ALDH1A1HSD17B10CASP1CASP7
SCHEMBL16045601 0.81 ALPL (0.33) MEN1KMT2AALPLBCL6CDK4
SCHEMBL1182019 0.77 ALPL (0.34) CYP1A2UCHL1ALPLDGAT1
SCHEMBL854982 0.76 NUDT1 (0.35) CYP1A2KMT2AUCHL1ALPL
SCHEMBL2066860 0.75 UCHL1 (0.32) UCHL1ALPLDGAT1
SCHEMBL15535603 0.73 ALPL (0.34) UCHL1ALPL
SCHEMBL16076005 0.73 ALPL (0.32) UCHL1ALPL
SCHEMBL2067804 0.73 LPL (0.45) CYP1A2CYP2C19ALDH1A1HSD17B10CASP1

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 12 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
US-8476294-B2 1H-imidazo[4,5-c]quinolinone derivatives NOVARTIS AG (CH) 2013-07-02 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
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG 2010-12-16 US 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
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 US 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 CYP1A2 2328/4885CYP2C19 3345/4885ALDH1A1 2472/4885
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 CYP1A2 2080/4885CYP2C19 3246/4885ALDH1A1 2405/4885
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 CYP1A2 2080/4885CYP2C19 3246/4885ALDH1A1 2405/4885

“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.