SCHEMBL723549

SCHEMBL723549

Oc1ccc(-c2ccnc3cc(-c4ccc(-c5nn[nH]n5)cc4)oc23)cn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.41
TNKS O95271 1/20 0.41
CLK1 P49759 2/20 0.40
DYRK1A Q13627 2/20 0.40
DYRK2 Q92630 2/20 0.40
DYRK1B Q9Y463 2/20 0.40
ADH5 P11766 1/20 0.39
MAP4K4 O95819 1/20 0.38
XDH P47989 3/20 0.36
SGK1 O00141 1/20 0.36
AXL P30530 1/20 0.36
KDM4E B2RXH2 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
RPA1 P27694 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL722395 0.88 MAP4K4 (0.42) HPGDSTNKSCLK1DYRK1ADYRK2
SCHEMBL725126 0.86 CYP2A6 (0.53) HPGDSTNKSADH5XDHSGK1
SCHEMBL15216706 0.85 XDH (0.52) HPGDSTNKSADH5MAP4K4XDH
SCHEMBL723550 0.85 XDH (0.41) HPGDSTNKSCLK1DYRK1ADYRK2
SCHEMBL724567 0.85 HPGDS (0.38) HPGDSTNKSCLK1DYRK1ADYRK2
SCHEMBL15209734 0.85 HPGDS (0.38) HPGDSTNKSCLK1DYRK1ADYRK2
SCHEMBL15216707 0.81 MYC (0.41) HPGDSTNKSADH5MAP4K4XDH
SCHEMBL721958 0.81 TNKS (0.39) HPGDSTNKSCLK1DYRK1ADYRK2
SCHEMBL723677 0.78 TNKS (0.38) TNKSADH5XDH
SCHEMBL724201 0.76 GRM5 (0.36) HPGDSTNKSADH5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP claimed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US claimed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US claimed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO claimed
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 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-20130225569-A1 FUROPYRIDINE DERIVATIVES SYK, FCGRT, SSB HPGDS 3161/4885TNKS 796/4885CLK1 1153/4885

“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.