SCHEMBL6795772

SCHEMBL6795772

CSc1ccc(C2CCN(CCCC(=O)Nc3ccccc3C(N)=O)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.53
HTR7 P34969 3/20 0.53
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HDAC1 Q13547 1/20 0.48
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
BCHE P06276 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.42
DRD2 P14416 1/20 0.42
PRCP P42785 1/20 0.41

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
SCHEMBL6795402 0.89 HTR1A (0.56) HTR1AHTR7KDM4EMEN1KMT2A
SCHEMBL6802419 0.89 HTR7 (0.57) HTR1AHTR7KDM4ECYP3A4CYP2D6
SCHEMBL6795910 0.85 HTR7 (0.53) HTR1AHTR7KDM4ECYP3A4CYP2D6
SCHEMBL6794897 0.83 HTR7 (0.53) HTR1AHTR7KDM4EKMT2AMAPT
SCHEMBL6802092 0.79 HTR1A (0.49) HTR1AHTR7KDM4EMEN1KMT2A
SCHEMBL9070717 0.75 ADRA1D (0.65) HTR1AHTR7CYP2D6CYP2C19ALDH1A1
SCHEMBL6798006 0.73 HTR1A (0.75) HTR1AHTR7KDM4EKMT2AALDH1A1
SCHEMBL11007751 0.73 POLB (0.59) HTR1AHTR7KDM4EMEN1KMT2A
SCHEMBL12946163 0.73 HTR1A (0.58) HTR1AHTR7KDM4EMEN1KMT2A
SCHEMBL11465879 0.72 CARM1 (0.54) HTR7MEN1KMT2ACYP3A4CYP2D6

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 1045/4885KDM4E 869/4885

“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.