SCHEMBL6802146

SCHEMBL6802146

O=c1[nH]c(CCCNCc2ccccc2-c2ccccc2)nc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 7/20 0.55
PDE10A Q9Y233 7/20 0.50
PARP2 Q9UGN5 1/20 0.49
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
TNKS2 Q9H2K2 2/20 0.47
KMT2A Q03164 1/20 0.46
TNKS O95271 1/20 0.46
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL6798276 0.84 PARP1 (0.57) PARP1PDE10APARP2MAPTTNKS2
SCHEMBL6790215 0.81 PARP1 (0.54) PARP1PDE10APARP2MAPTTNKS2
SCHEMBL6795593 0.79 PARP1 (0.64) PARP1PDE10APARP2LMNATNKS2
Hydrochloric Acid SCHEMBL6789135 0.79 PDE10A (0.70) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL6798298 0.79 PARP1 (0.60) PARP1PDE10APARP2MAPTTNKS2
SCHEMBL6795464 0.78 PARP1 (0.63) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL6795780 0.77 PARP1 (0.61) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL6791743 0.76 PARP1 (0.54) PARP1PDE10APARP2KDM4ELMNA
SCHEMBL23073611 0.75 PARP1 (0.73) PARP1PDE10APARP2KDM4ELMNA
SCHEMBL16404338 0.74 PDE10A (0.84) PARP1PDE10APARP2KDM4ELMNA

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 1/4885PDE10A 2013/4885PARP2 3/4885

“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.