SCHEMBL724620

SCHEMBL724620

COc1ccc(-c2cc3nccc(-c4ccc(OC)c(OC)c4)c3o2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.51
ADORA2A P29274 1/20 0.49
ALDH1A1 P00352 5/20 0.47
MAPK1 P28482 5/20 0.47
ABCB1 P08183 5/20 0.47
KDM4E B2RXH2 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
CYP3A4 P08684 3/20 0.47
MAPT P10636 3/20 0.47
HSD17B10 Q99714 3/20 0.47
ABCG2 Q9UNQ0 3/20 0.47
HPGD P15428 3/20 0.47
CYP1A1 P04798 2/20 0.46
CYP1B1 Q16678 2/20 0.46
CYP1A2 P05177 1/20 0.46
TERT O14746 1/20 0.44
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
ELANE P08246 1/20 0.43

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
SCHEMBL722578 0.89 TLR8 (0.42) PDE4AADORA2AALDH1A1MAPK1ABCB1
SCHEMBL723271 0.85 PDE4A (0.50) PDE4AALDH1A1MAPK1ABCB1KDM4E
SCHEMBL723093 0.83 PDE4C (0.55) ALDH1A1ABCB1KDM4ECYP3A4HPGD
SCHEMBL723558 0.83 ADORA2A (0.45) PDE4AADORA2AALDH1A1MAPK1ABCB1
SCHEMBL12503589 0.81 ALDH1A1 (0.46) ADORA2AALDH1A1KDM4ECYP3A4MAPT
SCHEMBL16845917 0.81 ADORA2A (0.40) PDE4AADORA2AALDH1A1MAPK1ABCB1
SCHEMBL16638610 0.81 PDE4C (0.47) ALDH1A1CYP3A4CYP1A1CYP1B1CYP1A2
SCHEMBL722239 0.80 TERT (0.47) ADORA2ACYP1A1CYP1B1CYP1A2TERT
SCHEMBL723435 0.80 EGFR (0.47) ALDH1A1MAPK1ABCB1KDM4EMEN1
SCHEMBL723624 0.80 PDE4C (0.47) ALDH1A1CYP3A4CYP1A1CYP1B1CYP1A2

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 14 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
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 PDE4A 2125/4885ADORA2A 1547/4885ALDH1A1 1457/4885

“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.