SCHEMBL6795780

SCHEMBL6795780

O=c1[nH]c(CCCNCCCCc2ccccc2)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.61
HCAR2 Q8TDS4 4/20 0.58
KMT2A Q03164 1/20 0.58
PDE10A Q9Y233 1/20 0.56
PARP2 Q9UGN5 1/20 0.54
MAOB P27338 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
TNKS2 Q9H2K2 1/20 0.52
HTR1A P08908 2/20 0.52
HTR7 P34969 2/20 0.52
ALDH1A1 P00352 1/20 0.52
PKM P14618 1/20 0.52
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL6795593 0.97 PARP1 (0.64) PARP1HCAR2KMT2APDE10APARP2
SCHEMBL6795464 0.94 PARP1 (0.63) PARP1HCAR2KMT2APDE10APARP2
SCHEMBL30176852 0.91 PARP1 (0.73) PARP1HCAR2KMT2APDE10APARP2
SCHEMBL6798298 0.89 PARP1 (0.60) PARP1HCAR2KMT2APDE10APARP2
SCHEMBL30176876 0.88 PARP1 (0.73) PARP1HCAR2KMT2APDE10APARP2
SCHEMBL29764103 0.82 PDE10A (0.74) PARP1KMT2APDE10APARP2MAOB
SCHEMBL11288070 0.82 PDE10A (0.74) PARP1KMT2APDE10APARP2MAOB
SCHEMBL6798276 0.81 PARP1 (0.57) PARP1KMT2APDE10APARP2TNKS2
SCHEMBL6790215 0.81 PARP1 (0.54) PARP1KMT2APDE10APARP2TNKS2
SCHEMBL6794764 0.81 PARP1 (0.60) PARP1HCAR2PDE10APARP2TNKS2

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 1/4885HCAR2 3453/4885KMT2A 1243/4885

“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.