SCHEMBL6794848

SCHEMBL6794848

O=c1[nH]c(CCCN2CCC(c3ccc(O)cc3)CC2)nc2ccccc12

nearest known ligand 0.86

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 15/20 0.86
PARP2 Q9UGN5 6/20 0.86
HTR1A P08908 2/20 0.59
HTR7 P34969 2/20 0.59
CHRNA7 P36544 1/20 0.54

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
SCHEMBL14981676 0.93 PARP1 (1.00) PARP1PARP2HTR1AHTR7CHRNA7
SCHEMBL6796319 0.87 PARP1 (0.81) PARP1PARP2HTR1AHTR7
SCHEMBL6795915 0.80 PARP1 (0.70) PARP1PARP2HTR1AHTR7
SCHEMBL31060680 0.80 PARP1 (1.00) PARP1PARP2HTR1AHTR7
SCHEMBL3400063 0.79 PARP1 (0.75) PARP1PARP2
SCHEMBL6800854 0.79 PARP1 (1.00) PARP1PARP2HTR1AHTR7CHRNA7
SCHEMBL9009912 0.78 PARP1 (0.67) PARP1PARP2HTR1AHTR7
SCHEMBL6791769 0.78 PARP1 (1.00) PARP1
SCHEMBL9009907 0.77 PARP1 (0.67) PARP1PARP2HTR1AHTR7
SCHEMBL14129617 0.77 PARP1 (0.64) PARP1PARP2HTR1AHTR7

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-20040077667-A1 Quinazolinone derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-22 US disclosed
EP-1355888-A1 QUINAZOLINONE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-10-29 EP disclosed
WO-2002048117-A1 QUINAZOLINONE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-06-20 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-20040077667-A1 Quinazolinone derivatives PARP1, PARP9, PARP2 PARP1 1/4885PARP2 3/4885HTR1A 848/4885

“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.