SCHEMBL4906293

SCHEMBL4906293

Cn1c(=O)c(C(=O)NCCO)c(O)c2ncc(Cc3ccc(F)cc3CO)cc21

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.39
HIF1A Q16665 7/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK14 Q16539 4/20 0.37
MAPK11 Q15759 2/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL14067484 0.94 MEN1 (0.43) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4908796 0.92 MEN1 (0.42) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4906366 0.92 KDM4E (0.44) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4901060 0.92 KDM4E (0.43) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4906700 0.92 KDM4E (0.43) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4906072 0.90 KDM4E (0.42) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4900928 0.90 KDM4E (0.42) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4591311 0.90 KDM4E (0.42) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4906937 0.90 KDM4E (0.42) KDM4EMEN1KMT2AL3MBTL1HIF1A
SCHEMBL4906999 0.90 KDM4E (0.45) KDM4EMEN1KMT2AL3MBTL1HIF1A

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-20080214527-A1 Hiv Integrase Inhibitors SHIONOGI & CO. LTD (JP) 2008-09-04 US disclosed
WO-2007019098-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO 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-20080214527-A1 Hiv Integrase Inhibitors API5, ING2, SAMHD1 KDM4E 1139/4885MEN1 4841/4885KMT2A 682/4885

“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.