SCHEMBL6674290

SCHEMBL6674290

COc1c(F)c(N2CCC(C3(N)CC3)C2)c(C)c2c1c(=O)[nH]c(=O)n2C1CC1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.47
SCN5A Q14524 1/20 0.47
CYP3A4 P08684 1/20 0.35

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
SCHEMBL6669217 0.90 KCNH2 (0.50) KCNH2SCN5A
SCHEMBL6668275 0.89 KCNH2 (0.38) KCNH2SCN5A
SCHEMBL6672152 0.89 KCNH2 (0.45) KCNH2SCN5ACYP3A4
SCHEMBL6673096 0.88 KCNH2 (0.49) KCNH2SCN5A
SCHEMBL6670377 0.87 KCNH2 (0.34) KCNH2
SCHEMBL6670555 0.85 KCNH2 (0.47) KCNH2SCN5A
SCHEMBL6671062 0.85 KCNH2 (0.41) KCNH2SCN5ACYP3A4
SCHEMBL6667677 0.83 KCNH2 (0.43) KCNH2
SCHEMBL6669001 0.82 KCNH2 (0.33) KCNH2SCN5A
SCHEMBL6674262 0.82 ALDH1A1 (0.33)

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
EP-1401830-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2004-03-31 EP claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US claimed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 WO claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 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-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance ABCC1, RPS6KA1, SIGMAR1 KCNH2 143/4885SCN5A 309/4885CYP3A4 240/4885

“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.