SCHEMBL723012

SCHEMBL723012

COc1ccc(OC)c(-c2cc3nccc(-c4cc(OC)ccc4OC)c3o2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
MAPT P10636 6/20 0.46
HPGD P15428 5/20 0.46
KDM4E B2RXH2 6/20 0.43
HSD17B10 Q99714 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 1/20 0.43
SLC9A1 P19634 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
RECQL P46063 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CCNT1 O60563 1/20 0.39
CDK9 P50750 1/20 0.39
MAPK1 P28482 3/20 0.39
DHFR P00374 1/20 0.38

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
SCHEMBL10267556 0.87 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL15210512 0.83 HTR7 (0.37) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL721816 0.83 LRRK2 (0.45)
SCHEMBL15210384 0.80 MAPK1 (0.43) SLC9A1L3MBTL1MAPK1
SCHEMBL722554 0.78 KDM4E (0.44) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL723261 0.78 PDE4C (0.43)
SCHEMBL723374 0.77 PDE4C (0.39) MAPT
SCHEMBL723435 0.76 EGFR (0.47) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL18339618 0.76 S1PR4 (0.34) ALDH1A1MAPTHPGDCCNT1CDK9
SCHEMBL723240 0.75 PDE4C (0.45) ALDH1A1MAPTHPGDKDM4EHSD17B10

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 ALDH1A1 1457/4885MAPT 4861/4885HPGD 4204/4885

“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.