SCHEMBL3515968

SCHEMBL3515968

CCNC(=O)C1=CC=CN[C]1NC

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
PLK1 P53350 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL3516641 0.65
SCHEMBL13018296 0.63 MMP1 (0.34) MMP1MMP2MMP3MMP9MMP8
SCHEMBL2067529 0.62 HDAC8 (0.34) PLK1
SCHEMBL9979308 0.62 SMN1; SMN2 (0.48) MMP1MMP2MMP3MMP9MMP8
SCHEMBL5909057 0.62 CA12 (0.58) CA12CA9ALDH1A1GAAPLK1
SCHEMBL24450192 0.61 KDM4E (0.32)
SCHEMBL21861916 0.61 MMP1 (0.32) MMP1MMP2MMP3MMP9MMP8
SCHEMBL13753745 0.61 HDAC3 (0.55) CA12CA9ALDH1A1PLK1
SCHEMBL13702393 0.60 PLK1 (0.66) CA12CA9ALDH1A1PLK1
SCHEMBL3478287 0.59 ADRA1D (0.56) CA9ALDH1A1GAA

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 3 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-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG 2010-12-16 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 (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 MMP1 4720/4885MMP2 4611/4885MMP3 4737/4885
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 MMP1 4720/4885MMP2 4611/4885MMP3 4737/4885

“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.