SCHEMBL2945203

SCHEMBL2945203

Clc1cccc(-c2cnc3ccc(NCCc4cccnc4)nn23)c1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 6/20 0.71
PIK3CD O00329 1/20 0.64
PIK3R1 P27986 1/20 0.64
FYN P06241 8/20 0.62
DYRK3 O43781 3/20 0.54
DYRK1A Q13627 3/20 0.54
DYRK2 Q92630 3/20 0.54
DYRK1B Q9Y463 3/20 0.54
CCNT1 O60563 2/20 0.54
CDK9 P50750 2/20 0.54
CDK5 Q00535 2/20 0.54
CDK5R1 Q15078 2/20 0.54
CCNA2 P20248 1/20 0.54
CDK2 P24941 1/20 0.54
MKNK1 Q9BUB5 2/20 0.53
KCNH2 Q12809 1/20 0.52

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
SCHEMBL13234278 0.90 FYN (0.73) PIM1FYNDYRK3DYRK1ADYRK2
SCHEMBL2951018 0.89 MKNK1 (0.67) PIM1PIK3CDPIK3R1FYNMKNK1
SCHEMBL13234372 0.88 PIM1 (0.74) PIM1PIK3CDPIK3R1FYNMKNK1
SCHEMBL2949676 0.87 PIM1 (0.65) PIM1PIK3CDPIK3R1FYNMKNK1
SCHEMBL2943040 0.87 PIK3CD (0.70) PIM1PIK3CDPIK3R1FYNMKNK1
SCHEMBL13234325 0.86 MKNK1 (0.61) PIM1FYNDYRK3DYRK1ADYRK2
SCHEMBL13223377 0.86 FYN (0.64) PIM1PIK3CDPIK3R1FYNMKNK1
SCHEMBL2944080 0.85 PIM1 (0.76) PIM1PIK3CDPIK3R1FYNDYRK3
SCHEMBL1054752 0.84 PIK3CD (0.72) PIM1PIK3CDPIK3R1FYNCCNT1
SCHEMBL2943531 0.84 FYN (0.76) PIM1FYNDYRK3DYRK1ADYRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 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-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments MAP4K2, MAP3K1, MAP3K2 PIM1 365/4885PIK3CD 101/4885PIK3R1 410/4885

“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.