SCHEMBL4906427

SCHEMBL4906427

CNC(=O)CCc1cc(F)ccc1Cc1cnc2c(O)c(C(=O)NCCOC)c(=O)n(C)c2c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIN2B Q13224 2/20 0.36
GRIN1 Q05586 1/20 0.36
HIF1A Q16665 7/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.34
EGLN1 Q9GZT9 2/20 0.34
TP53 P04637 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
SCHEMBL14067526 0.92 MEN1 (0.38) MEN1KMT2AHIF1AL3MBTL1KDM4E
SCHEMBL4906937 0.92 KDM4E (0.42) MEN1KMT2AHIF1AL3MBTL1KDM4E
SCHEMBL4895083 0.91 HIF1A (0.36) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL4906027 0.91 MEN1 (0.36) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL4908796 0.90 MEN1 (0.42) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL16021048 0.89 MEN1 (0.41) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL4907877 0.88 MEN1 (0.39) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL16021049 0.88 GRIN2B (0.41) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL4901109 0.88 HIF1A (0.38) MEN1KMT2AGRIN2BGRIN1HIF1A
SCHEMBL4904935 0.87 MEN1 (0.41) MEN1KMT2AGRIN2BGRIN1HIF1A

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
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 MEN1 4841/4885KMT2A 682/4885GRIN2B 4068/4885

“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.