SCHEMBL3519604

SCHEMBL3519604

O=C(O)c1c(O)c(Br)cc2nccnc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
TTR P02766 1/20 0.41
AKR1C4 P17516 2/20 0.38
AKR1C3 P42330 2/20 0.38
AKR1C2 P52895 2/20 0.38
AKR1C1 Q04828 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EGLN3 Q9H6Z9 2/20 0.37
PTPN1 P18031 3/20 0.35
DHODH Q02127 4/20 0.35
ALDH1A1 P00352 2/20 0.33
PTPN2 P17706 1/20 0.33
PTPN6 P29350 1/20 0.33

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
SCHEMBL3520304 0.79 EGLN3 (0.61) KDM4EEGLN3
SCHEMBL3520296 0.79 EGLN3 (0.37) KDM4EAKR1C2AKR1C1SMN1; SMN2MEN1
SCHEMBL3521085 0.79 DPP4 (0.44) KDM4ETTRAKR1C4AKR1C3AKR1C2
SCHEMBL3567138 0.76 FABP3 (0.42) HTTEGLN3ALDH1A1
SCHEMBL3524401 0.75 EGLN3 (0.46) EGLN3DHODHPDE10A
SCHEMBL3760733 0.73 GLRA3 (0.37) KDM4ETTRAKR1C4AKR1C3AKR1C2
SCHEMBL3567141 0.73 PTPN1 (0.45) EGLN3PTPN1PTPN2
SCHEMBL3303588 0.73 KDM4E (0.41) KDM4ESMN1; SMN2MEN1USP2TP53
SCHEMBL3521940 0.72 HPGD (0.41) KDM4ETTRMEN1HSP90AA1KMT2A
SCHEMBL7113177 0.72 TTR (0.58) KDM4ETTRAKR1C4AKR1C3AKR1C2

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-20100305133-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2010-12-02 US disclosed
EP-2227770-A2 PROLYL HYDROXYLASE INHIBITORS GlaxoSmithKline LLC (US) 2010-09-15 EP disclosed
WO-2009073497-A2 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-11 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-20100305133-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN3, EGLN2 KDM4E 176/4885TTR 4013/4885AKR1C4 412/4885

“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.