SCHEMBL8065074

SCHEMBL8065074

CCc1cc2ccc(CN3CCCC3)cc2[nH]c1=O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 18/20 0.65
KCNH2 Q12809 4/20 0.65
PARP2 Q9UGN5 7/20 0.63
DAO P14920 1/20 0.49
CHEK1 O14757 1/20 0.46

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
SCHEMBL8070885 0.90 PARP1 (0.63) PARP1KCNH2PARP2DAO
Hydrochloric Acid SCHEMBL31571003 0.88 PARP1 (0.62) PARP1KCNH2PARP2DAO
SCHEMBL8077817 0.84 PARP1 (0.61) PARP1KCNH2PARP2DAO
SCHEMBL31571052 0.84 PARP1 (0.60) PARP1KCNH2PARP2DAO
SCHEMBL8071284 0.84 PARP1 (0.71) PARP1KCNH2PARP2
SCHEMBL8077397 0.83 PARP1 (0.60) PARP1KCNH2PARP2
SCHEMBL8075232 0.83 PARP1 (0.56) PARP1KCNH2PARP2DAO
SCHEMBL8074912 0.82 PARP1 (0.56) PARP1KCNH2PARP2
SCHEMBL8067063 0.82 PARP1 (0.67) PARP1KCNH2PARP2
SCHEMBL8070707 0.82 PARP1 (0.69) PARP1KCNH2PARP2

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
US-8404713-B2 Quinolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-03-26 US disclosed
US-8404713-B2 Quinolinone derivatives as PARP inhibitors JANSSEN PHARMACEUTICA NV (BE) 2013-03-26 US disclosed
US-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-09-02 US disclosed
US-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-09-02 US disclosed
WO-2009053373-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-30 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-20100222348-A1 QUINOLINONE DERIVATIVES AS PARP INHIBITORS PARP1, PARP2, PARP11 PARP1 1/4885KCNH2 2542/4885PARP2 2/4885

“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.