SCHEMBL6798006

SCHEMBL6798006

NC(=O)c1ccccc1NC(=O)CCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.75
HTR7 P34969 6/20 0.75
CACNA1G O43497 5/20 0.64
TSHR P16473 2/20 0.62
LMNA P02545 2/20 0.55
PLA2G1B P04054 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ATG4B Q9Y4P1 1/20 0.55
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GFER P55789 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
SCHEMBL11446686 0.84 HTR7 (0.64) HTR1AHTR7
SCHEMBL11448262 0.81 HTR1A (0.58) HTR1AHTR7TSHRKMT2AGFER
SCHEMBL6802419 0.81 HTR7 (0.57) HTR1AHTR7KDM4EALDH1A1
SCHEMBL6801275 0.81 HTR1A (0.55) HTR1AHTR7CACNA1GTSHRLMNA
Hydrochloric Acid SCHEMBL11500448 0.81 HTR1A (0.57) HTR1AHTR7TSHRKMT2AGFER
SCHEMBL6797005 0.81 DRD2 (0.59) HTR1AHTR7KDM4EALDH1A1
SCHEMBL3207003 0.80 HTR1A (0.67) HTR1AHTR7CACNA1G
SCHEMBL11827948 0.80 HTR2A (0.53) HTR1AHTR7CACNA1GTSHRALDH1A1
SCHEMBL12946163 0.80 HTR1A (0.58) HTR1AHTR7CACNA1GKMT2ANPSR1
SCHEMBL8273954 0.80 HTR7 (0.55) HTR1AHTR7CACNA1GKDM4EALDH1A1

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 HTR1A 848/4885HTR7 1045/4885CACNA1G 4712/4885

“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.