SCHEMBL724102

SCHEMBL724102

Cn1cc(-c2ccnc3cc(-c4ccc5nsnc5c4)oc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 5/20 0.38
KDR P35968 2/20 0.38
MAP3K7 O43318 2/20 0.38
TAB1 Q15750 2/20 0.38
AURKA O14965 3/20 0.38
INCENP Q9NQS7 3/20 0.38
TPX2 Q9ULW0 3/20 0.38
ALK Q9UM73 1/20 0.38
MET P08581 4/20 0.35
LRRK2 Q5S007 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PI4KA P42356 1/20 0.35
PIK3CG P48736 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
ACVR1 Q04771 1/20 0.34
CCNC P24863 2/20 0.34
CDK8 P49336 2/20 0.34
TGFBR1 P36897 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
SCHEMBL10268949 0.86 AURKB (0.46) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL723364 0.82 WNT1 (0.41) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL725127 0.82 WNT1 (0.42) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL722397 0.81 AURKB (0.44) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL721989 0.81 ACVR1 (0.44) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL724101 0.81 AURKB (0.37) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL723727 0.80 FYN (0.40) AURKBKDRMAP3K7TAB1AURKA
SCHEMBL15209018 0.80 PIK3CA (0.40) MAP3K7TAB1ALKPIK3CA
SCHEMBL725506 0.80 KCNH2 (0.43) AURKBKDRAURKAINCENPTPX2
SCHEMBL722106 0.80 MTOR (0.47) AURKBKDRMAP3K7TAB1AURKA

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 10 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
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
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 AURKB 1443/4885KDR 263/4885MAP3K7 621/4885

“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.