SCHEMBL5934565

SCHEMBL5934565

CCN(C(=O)Cn1c(-c2ccc3nc(-c4sc(C)nc4C)ccc3c2)c(C2CCCCC2)c2ccc(C(=O)O)cc21)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.35
MMP12 P39900 1/20 0.35
KCNH2 Q12809 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
SCN9A Q15858 4/20 0.34
PTGER4 P35408 3/20 0.32
EGLN1 Q9GZT9 2/20 0.32
NR1I2 O75469 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
SCHEMBL5196593 0.89 KCNH2 (0.37) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL29532555 0.89 KCNH2 (0.37) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL4876105 0.88 KCNH2 (0.35) KCNH2HRH3
SCHEMBL5197919 0.88 KCNH2 (0.38) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL5196238 0.87 SCN9A (0.40) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL5218646 0.86 KCNH2 (0.39) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL5221066 0.85 TP53 (0.36) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL5225994 0.85 ALDH1A1 (0.38) MMP12KCNH2HRH3SCN9APTGER4
SCHEMBL5223193 0.84 PRKCA (0.37) PRKCAMMP12KCNH2HRH3SCN9A
SCHEMBL5198484 0.83 KCNH2 (0.37) KCNH2HRH3SCN9ANR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 US claimed
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 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-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses HAVCR2, ZC3HAV1, SARS1 PRKCA 4500/4885MMP12 4114/4885KCNH2 3202/4885

“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.