SCHEMBL4024810

SCHEMBL4024810

[O]CCCCN1CCN(C=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
HRH3 Q9Y5N1 1/20 0.36
KCNH2 Q12809 1/20 0.34
PAOX Q6QHF9 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
CCR3 P51677 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAD52 P43351 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL4023110 0.93 HSD17B10 (0.42) HSD17B10HRH3KCNH2PAOXSIGMAR1
SCHEMBL5574053 0.86 HSD17B10 (0.47) HSD17B10HRH3KCNH2PAOXSIGMAR1
SCHEMBL4023018 0.84 HSD17B10 (0.45) HSD17B10
SCHEMBL4024813 0.81 HSD17B10 (0.44) HSD17B10HRH3KCNH2PAOXSIGMAR1
SCHEMBL4901796 0.81 GNAI3 (0.52) HSD17B10KCNH2GNAI3GNAO1GNAI1
SCHEMBL31298039 0.80 HSD17B10 (0.57) HSD17B10HRH3SIGMAR1ALDH1A1
SCHEMBL4914105 0.79 GNAI3 (0.55) KCNH2GNAI3GNAO1GNAI1ALDH1A1
SCHEMBL21084328 0.79 GNAI3 (0.55) KCNH2GNAI3GNAO1GNAI1ALDH1A1
SCHEMBL4915224 0.78 GNAI3 (0.44) HSD17B10SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL31298041 0.78 HSD17B10 (0.60) HSD17B10HRH3SIGMAR1ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1528925-B1 QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2009-04-22 EP claimed
US-7504408-B2 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2009-03-17 US claimed
US-20050250797-A1 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2005-11-10 US claimed
US-7504408-B2 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2009-03-17 US disclosed
US-20050250797-A1 Quinzoline derivatives for use in the treatment of cancer ASTRAZENECA AB (SE) 2005-11-10 US 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-20050250797-A1 Quinzoline derivatives for use in the treatment of cancer TPD52L2, NQO2, CCNI HSD17B10 4141/4885HRH3 680/4885KCNH2 2694/4885

“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.