SCHEMBL3411209

SCHEMBL3411209

C[C@@H](c1ccc2c(cnn2CCOC2CCCCO2)c1)c1cnc2ccc(-c3cnn(C)c3)nn12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.41
PDE2A O00408 1/20 0.40
CHRM2 P08172 1/20 0.40
PDE4A P27815 1/20 0.40
PDE1A P54750 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE1C Q14123 1/20 0.40
PDE3A Q14432 1/20 0.40
PDE11A Q9HCR9 1/20 0.40
PDE10A Q9Y233 1/20 0.40
FYN P06241 7/20 0.36
TNF P01375 1/20 0.34
GRK5 P34947 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CG P48736 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL3434957 1.00 MET (0.41) METPDE2ACHRM2PDE4APDE1A
SCHEMBL3416448 0.87 MET (0.43) METPDE2ACHRM2PDE4APDE1A
SCHEMBL3416450 0.87 MET (0.43) METPDE2ACHRM2PDE4APDE1A
SCHEMBL4522723 0.85 MET (0.40) METIRAK4KDM4CNPC1RAB9A
SCHEMBL1657809 0.81 MET (0.50) METPDE2ACHRM2PDE4APDE1A
SCHEMBL3433565 0.81 MET (0.56) METPDE2ACHRM2PDE4APDE1A
SCHEMBL3414111 0.80 MET (0.42) METPDE2ACHRM2PDE4APDE1A
SCHEMBL4522197 0.79 MET (0.48) METTNFKDM4CNPC1RAB9A
SCHEMBL3409226 0.79 MET (0.41) METPDE2ACHRM2PDE4APDE1A
SCHEMBL1660036 0.78 MET (0.54) METPDE2ACHRM2PDE4APDE1A

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-8822468-B2 3-Methyl-imidazo[1,2-b]pyridazine derivatives NOVARTIS AG (CH) 2014-09-02 US disclosed
EP-2265614-A1 IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES FOR THE TREATMENT OF C-MET TYROSINE KINASE MEDIATED DISEASE Novartis AG (CH) 2010-12-29 EP disclosed
US-20090264406-A1 3-METHYL-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES NOVARTIS AG 2009-10-22 US disclosed
WO-2009106577-A1 IMIDAZO [1,2-B] PYRIDAZINE DERIVATIVES FOR THE TREATMENT OF C-MET TYROSINE KINASE MEDIATED DISEASE NOVARTIS AG (CH) 2009-09-03 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-20090264406-A1 3-METHYL-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES MET, ERBB2, ALK MET 1/4885PDE2A 1347/4885CHRM2 968/4885

“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.