SCHEMBL7096274

SCHEMBL7096274

Cc1c(N2CC(CN)C(C(F)(F)F)C2)c(F)cc2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.38
SCN5A Q14524 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL7093235 0.90 KCNH2 (0.37) KCNH2SCN5AJAK2JAK1TYK2
SCHEMBL6670690 0.89 KCNH2 (0.39) KCNH2SCN5A
SCHEMBL7093144 0.88 KCNH2 (0.41) KCNH2
SCHEMBL7094016 0.87 KCNH2 (0.36) KCNH2SCN5A
SCHEMBL7093016 0.87 KCNH2 (0.36) KCNH2SCN5AJAK2JAK1TYK2
SCHEMBL7096586 0.84 JAK2 (0.30) JAK2JAK1TYK2JAK3
SCHEMBL7092992 0.84 KCNH2 (0.36) KCNH2
SCHEMBL7093541 0.82 CACNA1F (0.34) KCNH2
SCHEMBL7092668 0.82 KCNH2 (0.31) KCNH2
SCHEMBL7093371 0.82

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-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US 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 309/4885JAK2 1738/4885

“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.