SCHEMBL5740372

SCHEMBL5740372

COc1ccc2nccc([C@H](O)CN3CCC(NCC(=O)Nc4ccncc4)CC3)c2c1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 9/20 0.61
KCNH2 Q12809 2/20 0.60
PREP P48147 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 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
SCHEMBL5728453 1.00 SLC2A1 (0.61) SLC2A1KCNH2PREPCYP2D6TSHR
SCHEMBL5728444 1.00 SLC2A1 (0.61) SLC2A1KCNH2PREPCYP2D6TSHR
SCHEMBL5739145 0.94 SLC2A1 (0.62) SLC2A1KCNH2
SCHEMBL5739137 0.94 SLC2A1 (0.62) SLC2A1KCNH2
SCHEMBL5739124 0.94 SLC2A1 (0.62) SLC2A1KCNH2
SCHEMBL5739832 0.92 SLC2A1 (0.63) SLC2A1KCNH2
SCHEMBL5739828 0.92 SLC2A1 (0.63) SLC2A1KCNH2
SCHEMBL5739835 0.92 SLC2A1 (0.63) SLC2A1KCNH2
SCHEMBL5727360 0.91 SLC2A1 (0.58) SLC2A1KCNH2
SCHEMBL5727351 0.91 SLC2A1 (0.58) SLC2A1KCNH2

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
EP-1719770-A2 Quinoline derivatives as antibacterials SMITHKLINE BEECHAM PLC (GB) 2006-11-08 EP disclosed
US-20040053928-A1 Quinoline derivatives as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2004-03-18 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-20040053928-A1 Quinoline derivatives as antibacterials AAAS, QDPR, QARS1 SLC2A1 3990/4885KCNH2 1839/4885PREP 558/4885

“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.