SCHEMBL15216705

SCHEMBL15216705

N#Cc1cncc(-c2ccnc3cc(-c4ccc(N5CCNCC5)cc4)oc23)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.47
MAPKAPK2 P49137 11/20 0.46
ACVR1 Q04771 5/20 0.44
PIM1 P11309 2/20 0.42
CDK9 P50750 2/20 0.42
CDC7 O00311 1/20 0.42
TGFBR1 P36897 3/20 0.41
ACVR1B P36896 2/20 0.41
KCNH2 Q12809 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
CDC42BPB Q9Y5S2 1/20 0.41
BMPR1B O00238 1/20 0.41
FLT3 P36888 1/20 0.41
BMPR1A P36894 1/20 0.41
ACVRL1 P37023 1/20 0.41
DDR1 Q08345 1/20 0.41
MAP4K5 Q9Y4K4 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
SCHEMBL15209104 0.86 MAPKAPK2 (0.48) CHEK1MAPKAPK2ACVR1PIM1CDK9
SCHEMBL722093 0.85 MAPKAPK2 (0.46) MAPKAPK2ACVR1PIM1CDK9CDC7
SCHEMBL723929 0.84 PIM1 (0.50) MAPKAPK2ACVR1PIM1TGFBR1ACVR1B
SCHEMBL723000 0.83 ACVR1 (0.47) ACVR1CDK9TGFBR1ACVR1BBMPR1B
SCHEMBL725049 0.82 PIM1 (0.41) ACVR1PIM1CDK9TGFBR1ACVR1B
SCHEMBL721482 0.80 ACVR1 (0.44) MAPKAPK2ACVR1PIM1CDK9TGFBR1
SCHEMBL722250 0.80 ACVR1 (0.51) ACVR1PIM1CDK9TGFBR1ACVR1B
SCHEMBL15216719 0.80 CCNC (0.41) ROCK2ROCK1CDC42BPBFLT3
SCHEMBL15216709 0.78 P4HTM (0.37) ROCK2ROCK1CDC42BPB
SCHEMBL722901 0.78 HRH3 (0.44) KCNH2

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 5 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
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 CHEK1 1743/4885MAPKAPK2 867/4885ACVR1 2178/4885

“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.