SCHEMBL935164

SCHEMBL935164

CN1CCCC(Nc2cc(-c3c[nH]c4nccnc34)cc(Cl)n2)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 9/20 0.55
GSK3B P49841 5/20 0.55
PIM1 P11309 4/20 0.44
PIM2 Q9P1W9 2/20 0.44
DAPK3 O43293 4/20 0.43
PAK4 O96013 4/20 0.43
PRKACA P17612 4/20 0.43
CDK8 P49336 4/20 0.43
PRKX P51817 4/20 0.43
MAP4K2 Q12851 4/20 0.43
STK3 Q13188 4/20 0.43
DYRK1A Q13627 4/20 0.43
MELK Q14680 4/20 0.43
MINK1 Q8N4C8 4/20 0.43
HIPK2 Q9H2X6 4/20 0.43
CLK4 Q9HAZ1 4/20 0.43
MAP4K5 Q9Y4K4 4/20 0.43
LRRK2 Q5S007 3/20 0.43
PKN2 Q16513 3/20 0.43
CHEK1 O14757 2/20 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
SCHEMBL935124 0.87 CDC7 (0.52) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL934236 0.86 CDC7 (0.71) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL935927 0.86 JAK2 (0.52) CDC7GSK3BPIM1DAPK3PAK4
SCHEMBL1045992 0.85 CDC7 (0.77) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL935037 0.84 ROCK2 (0.44) CDC7GSK3BPIM1DAPK3PAK4
SCHEMBL934361 0.83 GSK3B (0.50) CDC7GSK3BDAPK3PAK4PRKACA
SCHEMBL936028 0.82 CDC7 (0.57) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL6128670 0.81 CDC7 (0.54) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL935168 0.81 CDC7 (0.58) CDC7GSK3BPIM1PIM2DAPK3
SCHEMBL935166 0.81 CDC7 (0.58) CDC7GSK3BPIM1PIM2DAPK3

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454262-B1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LAB (US) 2014-05-14 EP claimed
EP-2454262-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES Abbott Laboratories (US) 2012-05-23 EP claimed
US-20110015172-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 US claimed
WO-2011008830-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 WO claimed
EP-2454262-B1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LAB (US) 2014-05-14 EP disclosed
US-8383624-B2 Pyrrolopyrazine inhibitors of kinases ABBOTT LABORATORIES (US) 2013-02-26 US disclosed
EP-2454262-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES Abbott Laboratories (US) 2012-05-23 EP disclosed
US-20110015172-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 US disclosed
WO-2011008830-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 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-20110015172-A1 PYRROLOPYRAZINE INHIBITORS OF KINASES CDC7, CDK7, CDK17 CDC7 1/4885GSK3B 307/4885PIM1 520/4885

“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.