SCHEMBL724908

SCHEMBL724908

COc1cc(-c2cc3nccc(-c4c(OC)cccc4OC)c3o2)cc(OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4C Q08493 3/20 0.53
RPS6KA2 Q15349 2/20 0.51
SYK P43405 1/20 0.44
BRD4 O60885 6/20 0.43
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
ADORA3 P0DMS8 2/20 0.43
CYP1A1 P04798 3/20 0.42
CYP1B1 Q16678 3/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
CYP1A2 P05177 1/20 0.41
ADORA2A P29274 1/20 0.41

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
SCHEMBL10268220 0.93 RPS6KA2 (0.49) PDE4CRPS6KA2SYKBRD4PTGES
SCHEMBL721634 0.92 RPS6KA2 (0.55) PDE4CRPS6KA2
SCHEMBL16845878 0.92 PDE4C (0.46) PDE4CRPS6KA2SYKALOX5ADORA3
SCHEMBL723093 0.91 PDE4C (0.55) PDE4CSYKBRD4PTGESALOX5
SCHEMBL722271 0.91 PDE4C (0.48) PDE4CRPS6KA2SYKBRD4PTGES
SCHEMBL15210354 0.89 PDE4C (0.44) PDE4CRPS6KA2SYKBRD4PTGES
SCHEMBL722839 0.86 PDE4C (0.51) PDE4CSYKBRD4PTGESALOX5
SCHEMBL722596 0.85 PDE4C (0.50) PDE4CSYKBRD4PTGESALOX5
SCHEMBL723596 0.85 RPS6KA2 (0.60) PDE4CRPS6KA2SYKADORA3
SCHEMBL16638609 0.85 PDE4C (0.50) PDE4CRPS6KA2SYKPTGESALOX5

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
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 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-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 PDE4C 2858/4885RPS6KA2 262/4885SYK 1/4885

“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.