SCHEMBL4935908

SCHEMBL4935908

CNC(=O)COc1cc(F)ccc1Cc1cnc2c(O)c(C(=O)NCCO)c(=O)n(C)c2c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
HIF1A Q16665 9/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK14 Q16539 5/20 0.36
MAPK11 Q15759 3/20 0.36
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL4901109 0.93 HIF1A (0.38) HIF1AMEN1KMT2ATHRBTSHR
SCHEMBL4898152 0.92 KDM4E (0.42) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL4900430 0.91 KDM4E (0.41) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL4591140 0.89 HIF1A (0.37) HIF1AMEN1KMT2ATHRBL3MBTL1
SCHEMBL4904850 0.88 KDM4E (0.41) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL4906937 0.87 KDM4E (0.42) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL4906999 0.86 KDM4E (0.45) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL4906293 0.86 KDM4E (0.48) KDM4EHIF1AMEN1KMT2AMAPK14
SCHEMBL14067462 0.86 HIF1A (0.39) KDM4EHIF1AMEN1KMT2AL3MBTL1
SCHEMBL4900371 0.86 ALDH1A1 (0.40) KDM4EHIF1AMEN1KMT2ATHRB

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 1 patent. 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

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 1139/4885HIF1A 3129/4885MEN1 4841/4885

“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.