SCHEMBL6673221

SCHEMBL6673221

C[C@H](NC(=O)OC(C)(C)C)C1CCN(c2nc3c(cc2F)c(=O)[nH]c(=O)n3C2CC2)C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 1/20 0.40
ACACB O00763 2/20 0.34
KCNH2 Q12809 5/20 0.33
TRPV1 Q8NER1 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CACNA1C Q13936 1/20 0.33
SCN5A Q14524 1/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
GFER P55789 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OGFRL1 Q5TC84 1/20 0.32

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
SCHEMBL6673219 1.00 EEF2K (0.40) EEF2KACACBKCNH2TRPV1CYP1A2
SCHEMBL7092547 0.86 EEF2K (0.42) EEF2KTRPV1PARP1OPRM1OPRD1
SCHEMBL6649040 0.86 EEF2K (0.42) EEF2KTRPV1PARP1OPRM1OPRD1
SCHEMBL4515887 0.85 KCNH2 (0.36) EEF2KACACBKCNH2CYP1A2CYP3A4
SCHEMBL4515891 0.85 KCNH2 (0.36) EEF2KACACBKCNH2CYP1A2CYP3A4
SCHEMBL13713236 0.85 KCNH2 (0.36) EEF2KACACBKCNH2CYP1A2CYP3A4
SCHEMBL7092552 0.84 KCNH2 (0.44) KCNH2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7092550 0.84 KCNH2 (0.44) KCNH2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7093091 0.83 KCNH2 (0.37) EEF2KKCNH2CYP1A2CYP3A4CYP2D6
SCHEMBL7093090 0.83 KCNH2 (0.37) EEF2KKCNH2CYP1A2CYP3A4CYP2D6

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
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 EEF2K 700/4885ACACB 4322/4885KCNH2 143/4885

“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.