SCHEMBL3376629

SCHEMBL3376629

CS(=O)(=O)Nc1ccc(-c2cccc(OC(F)(F)F)c2)c(F)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.54
ABL1 P00519 13/20 0.51
CYP17A1 P05093 1/20 0.45
SCN9A Q15858 1/20 0.44
SLC22A12 Q96S37 1/20 0.44
BCR P11274 1/20 0.43

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
SCHEMBL3377132 0.88 KIF11 (0.54) KIF11ABL1CYP17A1SCN9A
SCHEMBL3378380 0.87 KIF11 (0.53) KIF11ABL1CYP17A1SLC22A12
SCHEMBL3377794 0.87 DHODH (0.56) KIF11ABL1CYP17A1SLC22A12
SCHEMBL3375773 0.86 KIF11 (0.70) KIF11ABL1CYP17A1BCR
SCHEMBL3378867 0.86 KIF11 (0.52) KIF11ABL1CYP17A1
SCHEMBL3375676 0.83 KIF11 (0.52) KIF11ABL1CYP17A1SLC22A12
SCHEMBL3379953 0.83 KIF11 (0.74) KIF11ABL1BCR
SCHEMBL28058379 0.81 KIF11 (0.60) KIF11ABL1SLC22A12
SCHEMBL3375898 0.81 KIF11 (0.58) KIF11SCN9A
SCHEMBL13369737 0.79 CYP17A1 (0.54) KIF11CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US claimed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO claimed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 US claimed
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US disclosed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 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-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, HCN4, KCNH2 KIF11 3561/4885ABL1 1571/4885CYP17A1 3984/4885

“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.