SCHEMBL723017

SCHEMBL723017

CN(C)c1ccc(-c2ccnc3cc(-c4ccc(CCO)cc4)oc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.38
AURKB Q96GD4 6/20 0.38
KCNH2 Q12809 2/20 0.38
APP P05067 5/20 0.38
MAP3K11 Q16584 1/20 0.35
TDO2 P48775 1/20 0.34
MAPKAPK2 P49137 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
MAPT P10636 1/20 0.32
TGFBR1 P36897 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL723496 0.86 SYK (0.38) SYKAURKBKCNH2APPMAP3K11
SCHEMBL724885 0.84 MAPKAPK2 (0.35) MAPKAPK2
SCHEMBL723622 0.83 MAPKAPK2 (0.35) KCNH2MAPKAPK2
SCHEMBL15216716 0.83 RPS6KA3 (0.38) SYKTDO2HDAC6MAPT
SCHEMBL723393 0.82 MAPKAPK2 (0.35) SYKMAPKAPK2
SCHEMBL723996 0.81 MET (0.40) SYKAURKBKCNH2TGFBR1
SCHEMBL723599 0.81 PIK3CA (0.43) MAPKAPK2
SCHEMBL722906 0.80 GRM2 (0.36) KCNH2MAPKAPK2
SCHEMBL723329 0.79 MAPT (0.39) SYKAURKBKCNH2APPMAP3K11
SCHEMBL721690 0.79 AURKB (0.38) AURKBAPPMAPT

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 8 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
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
CN-103052640-A Furopyridine derivatives MERCK PATENT GMBH 2013-04-17 CN 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-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 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-20130225569-A1 FUROPYRIDINE DERIVATIVES SYK, FCGRT, SSB SYK 1/4885AURKB 1443/4885KCNH2 1087/4885

“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.