SCHEMBL721675

SCHEMBL721675

COc1cc(-c2cc3nccc(-c4ccnc(N(C)C5CCCNC5)c4)c3o2)cc(OC)c1OC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4C Q08493 3/20 0.37
BRD4 O60885 4/20 0.36
CCNT1 O60563 8/20 0.35
CDK9 P50750 8/20 0.35
SYK P43405 3/20 0.34
TGFBR1 P36897 1/20 0.34
ACVR1 Q04771 1/20 0.34
HTR2A P28223 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
SCHEMBL15210347 0.86 MAPK1 (0.35) CCNT1CDK9SYKTGFBR1ACVR1
SCHEMBL10267561 0.82 MAPK1 (0.41) PDE4CBRD4CCNT1CDK9
SCHEMBL15210404 0.79 SYK (0.40) BRD4CCNT1CDK9SYK
SCHEMBL721674 0.79 SYK (0.40) BRD4CCNT1CDK9SYK
SCHEMBL10266957 0.79 PRKCI (0.41) PDE4CBRD4
SCHEMBL723093 0.78 PDE4C (0.55) PDE4CBRD4SYK
SCHEMBL722998 0.74 PDE4C (0.41) PDE4CBRD4SYKTGFBR1ACVR1
SCHEMBL723624 0.74 PDE4C (0.47) PDE4CBRD4SYK
SCHEMBL15210345 0.73 ROCK2 (0.43) BRD4SYK
SCHEMBL15210385 0.73 PDE4C (0.46) PDE4CBRD4SYK

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 6 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

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 2858/4885BRD4 1150/4885CCNT1 459/4885

“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.