SCHEMBL4591069

SCHEMBL4591069

Cn1c(=O)c(C(=O)O)c(O)c2ncc(Cc3ccc(F)cc3OCC(N)=O)cc21

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
HIF1A Q16665 6/20 0.35
MAPK14 Q16539 1/20 0.34
FEN1 P39748 2/20 0.33
ERCC5 P28715 1/20 0.33
GAA P10253 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
BRPF1 P55201 1/20 0.32
GLA P06280 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTGER1 P34995 1/20 0.32
GRM2 Q14416 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL4591140 0.90 HIF1A (0.37) MEN1KMT2ALMNAHIF1AGRIN1
SCHEMBL4576446 0.90 GRIN2B (0.36) MEN1KMT2ALMNAHIF1AGRIN1
SCHEMBL5546555 0.89 HDAC3 (0.38) MEN1KMT2AHIF1AFEN1ERCC5
SCHEMBL4898152 0.88 KDM4E (0.42) MEN1KMT2AHIF1AMAPK14
SCHEMBL14067462 0.88 HIF1A (0.39) MEN1KMT2AHIF1A
SCHEMBL5548083 0.87 MEN1 (0.35) MEN1KMT2ALMNAHIF1AFEN1
SCHEMBL4907166 0.87 HIF1A (0.38) MEN1KMT2AHIF1AGRIN1GRIN2B
SCHEMBL4575589 0.86 HRH1 (0.39) MEN1KMT2ALMNAHIF1AERCC5
SCHEMBL5545343 0.86 MEN1 (0.36) MEN1KMT2ALMNAHIF1AMAPK14
SCHEMBL4903463 0.84 ALDH1A1 (0.41) MEN1KMT2ALMNAHIF1ASMN1; SMN2

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-20080214527-A1 Hiv Integrase Inhibitors SHIONOGI & CO. LTD (JP) 2008-09-04 US claimed
EP-1910363-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP claimed
WO-2007019098-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO claimed
EP-1910363-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP 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 MEN1 4841/4885KMT2A 682/4885LMNA 4059/4885

“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.