SCHEMBL2067150

SCHEMBL2067150

Cc1nn(CC(=O)N(C)C)cc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCNC P24863 2/20 0.43
CDK8 P49336 2/20 0.43
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 2/20 0.36
ATM Q13315 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL2066748 0.87 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2LMNAPOLBATM
SCHEMBL25925101 0.83 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAPOLBTP53
SCHEMBL3514895 0.83 L3MBTL1 (0.43) ALDH1A1SMN1; SMN2LMNATP53HTT
SCHEMBL1559248 0.81 MITF (0.51) ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL15080872 0.78 CCNC (0.48) CCNCCDK8ALDH1A1NPSR1SMN1; SMN2
SCHEMBL25925092 0.76 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2LMNATP53L3MBTL1
SCHEMBL18463627 0.76 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2LMNAPOLBTP53
SCHEMBL17610365 0.76 ALDH1A1 (0.40) ALDH1A1NPSR1SMN1; SMN2LMNAPOLB
SCHEMBL1559636 0.75 ALDH1A1 (0.43) ALDH1A1LMNAPOLBTP53KMT2A
SCHEMBL3517473 0.75 CCNC (0.46) CCNCCDK8ALDH1A1NPSR1SMN1; SMN2

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 7 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
EP-2438064-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES 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
WO-2010139731-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2010-12-09 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 (2 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-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 CCNC 2418/4885CDK8 241/4885ALDH1A1 2405/4885
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 CCNC 2418/4885CDK8 241/4885ALDH1A1 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.