SCHEMBL725080

SCHEMBL725080

COc1cc(-c2cc3nccc(Nc4ccc5[nH]ccc5c4C)c3o2)cc(OC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.45
JAK3 P52333 1/20 0.45
BRD4 O60885 3/20 0.43
PRKCQ Q04759 2/20 0.42
PRKCD Q05655 2/20 0.42
GAK O14976 13/20 0.41
RIPK2 O43353 8/20 0.41
COQ8A Q8NI60 8/20 0.41
NLK Q9UBE8 8/20 0.41
EPHB6 O15197 2/20 0.41
ABL1 P00519 2/20 0.41
ACVR1 Q04771 2/20 0.41
BMPR1B O00238 1/20 0.41
EGFR P00533 1/20 0.41
LCK P06239 1/20 0.41
SRC P12931 1/20 0.41
EPHA1 P21709 1/20 0.41
EPHA8 P29322 1/20 0.41
MAP2K5 Q13163 1/20 0.41
STK16 O75716 1/20 0.39

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
SCHEMBL723540 0.92 PRKCQ (0.37) JAK2JAK3BRD4PRKCQPRKCD
SCHEMBL725010 0.91 PRKCQ (0.50) JAK2JAK3PRKCQPRKCDEGFR
SCHEMBL721499 0.88 PRKCQ (0.43) JAK2JAK3PRKCQPRKCDLCK
SCHEMBL723994 0.87 PRKCQ (0.43) JAK2JAK3BRD4PRKCQPRKCD
SCHEMBL10267539 0.87 PRKCQ (0.47) PRKCQPRKCDRIPK2LCK
SCHEMBL722305 0.86 PRKCQ (0.43) JAK2JAK3BRD4PRKCQPRKCD
SCHEMBL723489 0.86 PRKCQ (0.37) PRKCQPRKCDLCK
SCHEMBL723524 0.84 PRKCQ (0.44) PRKCQPRKCDEGFRLCK
SCHEMBL721627 0.84 MAPKAPK2 (0.40) PRKCQPRKCDLCK
SCHEMBL10268104 0.84 PRKCQ (0.51) JAK2JAK3PRKCQPRKCD

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
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
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
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 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 JAK2 14/4885JAK3 154/4885BRD4 1150/4885

“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.