SCHEMBL20679341

SCHEMBL20679341

O=C1COc2ncc(CNC3CCN(C[C@@H]4Cn5c(=O)cnc6ccc(F)c4c65)CC3)nc2N1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 14/20 0.65
KCNQ1 P51787 1/20 0.45
CACNA1C Q13936 1/20 0.45
SLC2A1 P11166 1/20 0.41

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
SCHEMBL2937890 0.91 KCNH2 (0.66) KCNH2KCNQ1CACNA1C
Hydrochloric Acid SCHEMBL2935882 0.90 KCNH2 (0.66) KCNH2KCNQ1CACNA1C
SCHEMBL21314998 0.88 KCNH2 (0.51) KCNH2KCNQ1CACNA1C
SCHEMBL3547464 0.85 KCNH2 (0.75) KCNH2KCNQ1CACNA1C
SCHEMBL20679459 0.82 KCNH2 (0.46) KCNH2KCNQ1CACNA1C
SCHEMBL13178044 0.80 KCNH2 (0.56) KCNH2KCNQ1CACNA1CSLC2A1
SCHEMBL3153796 0.80 KCNH2 (0.73) KCNH2
SCHEMBL2931641 0.79 KCNH2 (0.88) KCNH2SLC2A1
SCHEMBL2930373 0.79 KCNH2 (1.00) KCNH2SLC2A1
SCHEMBL3542993 0.79 KCNH2 (0.62) KCNH2KCNQ1CACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10683307-B2 Compounds for use in antibacterial applications GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-06-16 US disclosed
US-20190270755-A1 COMPOUNDS FOR USE IN ANTIBACTERIAL APPLICATIONS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-09-05 US disclosed
US-10364254-B2 Compounds for use in antibacterial applications GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-07-30 US disclosed
US-20190031680-A1 COMPOUNDS FOR US IN ANTIBACTERIAL APPLICATIONS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-31 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 (4 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-10683307-B2 Compounds for use in antibacterial applications MRPL21, CFTR, NRDC KCNH2 2823/4885KCNQ1 2666/4885CACNA1C 4304/4885
US-20190270755-A1 COMPOUNDS FOR USE IN ANTIBACTERIAL APPLICATIONS MRPL21, CFTR, NRDC KCNH2 2823/4885KCNQ1 2666/4885CACNA1C 4304/4885
US-20190031680-A1 COMPOUNDS FOR US IN ANTIBACTERIAL APPLICATIONS CFTR, MRPL21, CLPP KCNH2 2998/4885KCNQ1 3170/4885CACNA1C 4419/4885
US-10364254-B2 Compounds for use in antibacterial applications MRPL21, CFTR, NRDC KCNH2 2823/4885KCNQ1 2666/4885CACNA1C 4304/4885

“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.