SCHEMBL3876102

SCHEMBL3876102

[CH2]CCC(C)Oc1ccc2ncc(-c3ccc(Cl)s3)n2n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 10/20 0.41
MKNK2 Q9HBH9 2/20 0.41
DYRK3 O43781 4/20 0.35
DYRK1A Q13627 4/20 0.35
DYRK2 Q92630 4/20 0.35
DYRK1B Q9Y463 4/20 0.35
CCNA2 P20248 2/20 0.35
CDK2 P24941 2/20 0.35
FYN P06241 3/20 0.34
CCNT1 O60563 3/20 0.33
CDK9 P50750 3/20 0.33
CDK5 Q00535 2/20 0.33
CDK5R1 Q15078 2/20 0.33
PIM1 P11309 2/20 0.32
LRRK2 Q5S007 1/20 0.32

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
SCHEMBL3866093 0.84 MKNK1 (0.38) MKNK1MKNK2DYRK3DYRK1ADYRK2
SCHEMBL3872007 0.80 MKNK1 (0.49) MKNK1MKNK2
SCHEMBL3868130 0.80 MKNK1 (0.46) MKNK1MKNK2DYRK3DYRK1ADYRK2
SCHEMBL3865301 0.78 MKNK1 (0.43) MKNK1MKNK2DYRK3DYRK1ADYRK2
SCHEMBL3866891 0.73 MKNK1 (0.40) MKNK1DYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3871342 0.72 SIGMAR1 (0.39) MKNK1DYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3864097 0.71 MKNK1 (0.39) MKNK1MKNK2DYRK3DYRK1ADYRK2
SCHEMBL3875142 0.71 SIGMAR1 (0.44) MKNK1DYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3866887 0.71 PIM1 (0.40) MKNK1DYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3866297 0.71 PIM1 (0.43) MKNK1MKNK2DYRK3DYRK1ADYRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8653076-B2 Oxo-substituted imidazo[1,2B]pyridazines, their preparation and use as pharmaceuticals BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-18 US disclosed
US-20090093475-A1 Oxo-substituted imidazo[1,2b]pyridazines, their preparation and use as pharmaceuticals BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-04-09 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-20090093475-A1 Oxo-substituted imidazo[1,2b]pyridazines, their preparation and use as pharmaceuticals CDK2, CDK1, MAP4K2 MKNK1 299/4885MKNK2 203/4885DYRK3 491/4885

“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.