SCHEMBL6673258

SCHEMBL6673258

COc1c(N2CCCC2)c(F)c(N)c2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EEF2K O00418 1/20 0.32
PKM P14618 1/20 0.32
CACNA1F O60840 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
CACNA1D Q01668 1/20 0.32
KCNH2 Q12809 1/20 0.32
CACNA1S Q13698 1/20 0.32
CACNA1C Q13936 1/20 0.32
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
GAA P10253 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
SCHEMBL6673571 0.92 ALDH1A1 (0.32) ALDH1A1EEF2KCACNA1FPOLBMAPK1
SCHEMBL7097498 0.91 MEN1 (0.35) ALDH1A1EEF2KKCNH2KMT2A
SCHEMBL6647153 0.88 ALDH1A1 (0.40) EPHX2ALDH1A1NPSR1EEF2KPKM
SCHEMBL6668532 0.88 ALDH1A1 (0.33) EPHX2ALDH1A1NPSR1PKMMAPT
SCHEMBL6642661 0.88 TOP1 (0.34) ALDH1A1EEF2KCACNA1FPOLBMAPK1
SCHEMBL6644192 0.86 KCNH2 (0.33) ALDH1A1EEF2KCACNA1FPOLBMAPK1
SCHEMBL6644816 0.85 ALDH1A1 (0.32) EPHX2ALDH1A1NPSR1PKMPOLB
SCHEMBL6669323 0.85 KCNH2 (0.34) ALDH1A1EEF2KCACNA1FPOLBMAPK1
SCHEMBL6672446 0.85 KCNH2 (0.45) KCNH2
SCHEMBL6674594 0.85 KCNH2 (0.31) CACNA1FPOLBMAPK1CACNA1DKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US claimed
EP-1401830-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2004-03-31 EP disclosed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US disclosed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 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-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance ABCC1, RPS6KA1, SIGMAR1 EPHX2 4469/4885ALDH1A1 781/4885NPSR1 1596/4885

“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.