SCHEMBL5651445

SCHEMBL5651445

COc1ccc2ncc(F)c(CCN3C[C@H]4CC(NCc5ccc6c(n5)NC(=O)CS6)C[C@H]4C3)c2n1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.63
SLC2A1 P11166 1/20 0.51

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
SCHEMBL14367720 1.00 KCNH2 (0.63) KCNH2SLC2A1
SCHEMBL3285345 0.92 KCNH2 (0.59) KCNH2
SCHEMBL4912549 0.91 KCNH2 (0.60) KCNH2
SCHEMBL14087088 0.91 KCNH2 (0.60) KCNH2
Hydrochloric Acid SCHEMBL6079657 0.90 KCNH2 (0.75) KCNH2SLC2A1
SCHEMBL5652429 0.90 KCNH2 (0.60) KCNH2
SCHEMBL67871 0.90 KCNH2 (0.60) KCNH2
SCHEMBL5652645 0.90 KCNH2 (0.60) KCNH2
SCHEMBL5649625 0.90 KCNH2 (0.60) KCNH2
SCHEMBL5649205 0.90 KCNH2 (0.60) KCNH2

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-20070270417-A1 Antibacterial Agents GLAXO GROUP LIMITED (GB) 2007-11-22 US claimed
US-20070270417-A1 Antibacterial Agents GLAXO GROUP LIMITED (GB) 2007-11-22 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-20070270417-A1 Antibacterial Agents NQO2, NQO1, NDUFV2 KCNH2 2615/4885SLC2A1 3908/4885

“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.