SCHEMBL5091970

SCHEMBL5091970

NC1(CCCNc2nccc(-c3ccc(O)cc3)n2)N=c2ccccc2=N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
JAK2 O60674 1/20 0.39
PLK1 P53350 2/20 0.38
DYRK1B Q9Y463 3/20 0.38
VCP P55072 1/20 0.36
CAMK2D Q13557 1/20 0.36
MKNK1 Q9BUB5 3/20 0.35
FLT3 P36888 1/20 0.35
TYRO3 Q06418 1/20 0.35
MERTK Q12866 1/20 0.35
GAS6 Q14393 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPT P10636 1/20 0.35
ATM Q13315 1/20 0.35
EIF2AK2 P19525 1/20 0.35

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
SCHEMBL7854766 0.87 JAK2 (0.35) PIM1PIM2JAK2PLK1DYRK1B
SCHEMBL5101136 0.75 DRD4 (0.51) PIM1PIM2JAK2DYRK1BVCP
SCHEMBL5091987 0.70 CXCR4 (0.50) PIM1PIM2PLK1MKNK1MKNK2
SCHEMBL5100134 0.70 MKNK1 (0.46) PLK1DYRK1BMKNK1MKNK2KMT2A
SCHEMBL5100147 0.70 POLB (0.48) MAPTEIF2AK2
SCHEMBL7104522 0.70 JAK2 (0.38) PIM1PIM2JAK2PLK1DYRK1B
SCHEMBL5091556 0.69 DYRK1A (0.56) JAK2DYRK1BMEN1KMT2ANPC1
SCHEMBL5091979 0.67 PLK1 (0.39) PIM1PIM2JAK2PLK1DYRK1B
SCHEMBL5092000 0.67 PLK1 (0.39) PIM1PIM2JAK2PLK1DYRK1B
SCHEMBL7104529 0.67 EIF2AK2 (0.40) JAK2PLK1DYRK1BVCPMKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7425557-B2 Inhibitors of glycogen synthase kinase 3 NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-16 US disclosed
US-7045519-B2 Inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION (US) 2006-05-16 US disclosed
US-7037918-B2 Inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION (US) 2006-05-02 US disclosed
US-20060089369-A1 Inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION (US) 2006-04-27 US disclosed
US-20030130289-A1 Inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION 2003-07-10 US disclosed
EP-1317433-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2003-06-11 EP disclosed
US-6489344-B1 FOR TREATMENT DIABETES IN A HUMAN OR ANIMAL SUBJECT CHIRON CORPORATION 2002-12-03 US disclosed
US-20020156087-A1 Inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION 2002-10-24 US disclosed
US-6417185-B1 HETEROCYCLIC ENZYME INHIBITORS CHIRON CORPORATION 2002-07-09 US disclosed
WO-2002020495-A2 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2002-03-14 WO disclosed
EP-1087963-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 Chiron Corporation (US) 2001-04-04 EP disclosed
WO-1999065897-A1 INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 1999-12-23 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 (3 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-20030130289-A1 Inhibitors of glycogen synthase kinase 3 GSK3B, GSK3A, PYGB PIM1 743/4885PIM2 1371/4885JAK2 598/4885
US-20060089369-A1 Inhibitors of glycogen synthase kinase 3 GSK3B, GSK3A, PYGB PIM1 699/4885PIM2 1313/4885JAK2 597/4885
US-20020156087-A1 Inhibitors of glycogen synthase kinase 3 GSK3B, GSK3A, PYGB PIM1 699/4885PIM2 1313/4885JAK2 597/4885

“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.