SCHEMBL4998957

SCHEMBL4998957

CCOP(=O)(CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(-c2ccc(F)cc2)c1=O)OCC

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
EGLN1 Q9GZT9 2/20 0.36
HIF1A Q16665 1/20 0.34
TLR2 O60603 2/20 0.33
CNR2 P34972 2/20 0.33
TP53 P04637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
TOP2A P11388 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
SCHEMBL4998701 0.90 MEN1 (0.46) L3MBTL1MEN1KMT2AHIF1AKDM4E
SCHEMBL4761144 0.89 EGLN1 (0.40) L3MBTL1MEN1KMT2AEGLN1HIF1A
SCHEMBL5545627 0.87 GRIN2B (0.40) L3MBTL1MEN1KMT2AEGLN1HIF1A
SCHEMBL14072845 0.86 L3MBTL1 (0.39) L3MBTL1MEN1KMT2AHIF1ACNR2
SCHEMBL5540886 0.86 MEN1 (0.41) L3MBTL1MEN1KMT2AEGLN1HIF1A
SCHEMBL4585532 0.86 GRIN2B (0.41) L3MBTL1MEN1KMT2ATP53KDM4E
SCHEMBL4761119 0.85 MEN1 (0.44) L3MBTL1MEN1KMT2AHIF1AKDM4E
SCHEMBL5540495 0.85 EGLN1 (0.41) L3MBTL1MEN1KMT2AEGLN1HIF1A
SCHEMBL5004742 0.85 MEN1 (0.44) L3MBTL1MEN1KMT2AHIF1AKDM4E
SCHEMBL5545896 0.83 MEN1 (0.40) L3MBTL1MEN1KMT2AEGLN1HIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US claimed
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 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-20080214503-A1 Hiv Integrase Inhibitors SAMHD1, ACIN1, API5 L3MBTL1 1487/4885MEN1 4822/4885KMT2A 1762/4885

“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.